ch 3 hc o ch3 n h - swgdrug · 2015. 2. 9. · ch3 ch3 3 hc o form chemical formula molecular...

5
5-Methoxy-diethyltryptamine The Drug Enforcement Administration's Special Testing and Research Laboratory generated this monograph using structurally confirmed reference material. Page 1 of 5 SWGDRUG.org/monographs.htm Latest Revision: 1/8/2015 N H N CH 3 CH 3 O C H 3 Form Chemical Formula Molecular Weight Melting Point ( o C) Base C 15 H 22 N 2 O 246 Not Determined HCl C 15 H 22 N 2 O . HCl 282 Not Determined 1. GENERAL INFORMATION IUPAC Name: CAS#: Synonyms: Source: Appearance: UV max (nm): N,N-diethyl-2-(5-methoxy-1H-indol-3-yl)ethanamine Not Available 5-Methoxy-DET, 5-MeO-DET DEA Reference Material Collection Brown powder Not Determined 2. CHEMICAL AND PHYSICAL DATA 2.1 CHEMICAL DATA

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Page 1: CH 3 HC O CH3 N H - SWGDRUG · 2015. 2. 9. · CH3 CH3 3 HC O Form Chemical Formula Molecular Weight Melting Point (oC) Base C15H22N2O 246 Not Determined HCl C15H22N2O. HCl 282 Not

5-Methoxy-diethyltryptamineThe Drug Enforcement Administration's Special Testing and Research Laboratory

generated this monograph using structurally confirmed reference material.

Page 1 of 5SWGDRUG.org/monographs.htmLatest Revision: 1/8/2015

NH

NCH3

CH3OCH3

Form Chemical Formula Molecular Weight Melting Point (oC)

Base C15H22N2O 246 Not Determined

HCl C15H22N2O. HCl 282 Not Determined

1. GENERAL INFORMATION

IUPAC Name:

CAS#:

Synonyms:

Source:

Appearance:

UVmax(nm):

N,N-diethyl-2-(5-methoxy-1H-indol-3-yl)ethanamine

Not Available

5-Methoxy-DET, 5-MeO-DET

DEA Reference Material Collection

Brown powder

Not Determined

2. CHEMICAL AND PHYSICAL DATA

2.1 CHEMICAL DATA

Page 2: CH 3 HC O CH3 N H - SWGDRUG · 2015. 2. 9. · CH3 CH3 3 HC O Form Chemical Formula Molecular Weight Melting Point (oC) Base C15H22N2O 246 Not Determined HCl C15H22N2O. HCl 282 Not

5-Methoxy-diethyltryptamineThe Drug Enforcement Administration's Special Testing and Research Laboratory

generated this monograph using structurally confirmed reference material.

Page 2 of 5SWGDRUG.org/monographs.htmLatest Revision: 1/8/2015

3. QUALITATIVE DATA

3.1 NUCLEAR MAGNETIC RESONANCE

Sample Preparation: Dilute analyte to ~25 mg/mL inD2O containing TSP for 0 ppm reference and maleicacid as quantitative internal standard.

Instrument: 400 MHz NMR spectrometerParameters: Spectral width: at least containing -3 ppm through 13 ppm

Pulse angle: 90o

Delay between pulses: 45 seconds1H NMR: 5-Methoxy-diethyltryptamine HCl Lot 2DAK-29-05; D2O; 400MHz

8 7 6 5 4 3 2 1 0

0

1

2

3

4

5

6

7

8

9

10

66231111

TMSMaleic Acid

HDO

7.25 7.00

0

0.25

0.50

1111

3.4 3.3 3.2 3.1

62

1.275

6

3.900

3

Page 3: CH 3 HC O CH3 N H - SWGDRUG · 2015. 2. 9. · CH3 CH3 3 HC O Form Chemical Formula Molecular Weight Melting Point (oC) Base C15H22N2O 246 Not Determined HCl C15H22N2O. HCl 282 Not

5-Methoxy-diethyltryptamineThe Drug Enforcement Administration's Special Testing and Research Laboratory

generated this monograph using structurally confirmed reference material.

Page 3 of 5SWGDRUG.org/monographs.htmLatest Revision: 1/8/2015

3.2 GAS CHROMATOGRAPHY/MASS SPECTROMETRY

Sample Preparation: Dilute analyte ~4 mg/mL base extracted into chloroform.

Instrument:Column:Carrier Gas:Temperatures:

Agilent gas chromatograph operated in split mode with MS detector HP-5 MS (or equivalent); 30m x 0.25 mm x 0.25 µmHelium at 1 mL/minInjector: 280oCMSD transfer line: 280oCMS Source: 230oCMS Quad: 150oCOven program:

1) 100oC initial temperature for 1.0 min2) Ramp to 300oC at 12 oC/min3) Hold final temperature for 9.0 min

Injection Parameters: Split Ratio = 20:1, 1 µL injectedMS Parameters: Mass scan range: 30-550 amu

Threshold: 100Tune file: stune.uAcquisition mode: scan

Retention Time: 14.090 minEI Mass Spectrum: 5-Methoxy-diethyltryptamine HCl Lot # 2DAK-29-05

m/z240220200180160140120100806040

[x 1

06 ]In

tens

ity

1

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303030 3030303030 3030303030 3030303030 30303030

424242 4242424242 4242424242 4242424242 42424242

585858 5858585858 5858585858 5858585858 58585858636363 6363636363 6363636363 6363636363 63636363 777777 7777777777 7777777777 7777777777 77777777

868686 8686868686 8686868686 8686868686 86868686

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EI+

Page 4: CH 3 HC O CH3 N H - SWGDRUG · 2015. 2. 9. · CH3 CH3 3 HC O Form Chemical Formula Molecular Weight Melting Point (oC) Base C15H22N2O 246 Not Determined HCl C15H22N2O. HCl 282 Not

5-Methoxy-diethyltryptamineThe Drug Enforcement Administration's Special Testing and Research Laboratory

generated this monograph using structurally confirmed reference material.

Page 4 of 5SWGDRUG.org/monographs.htmLatest Revision: 1/8/2015

3.3 INFRARED SPECTROSCOPY (FTIR)

Insrument: FTIR with diamond ATR attachment (1 bounce)Scan Parameters: Number of scans: 32

Number of background scans: 32Resolution: 4 cm-1

Sample gain: 8Aperture: 150

FTIR ATR (Diamond, 1 Bounce): 5-Methoxy-diethyltryptamine HCl Lot # 2DAK-29-05

Wavenumber (cm-1)3500 3000 2500 2000 1500

%Tr

ansm

ittan

ce

20

30

40

50

60

70

432432432432432432432432432432432432432432432432432432432432432432

642642642642642642642642642642642642642642642642642642642642642642

700700700700700700700700700700700700700700700700700700700700700700

810810810810810810810810810810810810810810810810810810810810810810

823823823823823823823823823823823823823823823823823823823823823823

92692692692692692692692692692692692692692692692692692692692692692610281028102810281028102810281028102810281028102810281028102810281028102810281028102810281099

109910991099109910991099109910991099109910991099109910991099109910991099109910991099

1178117811781178117811781178117811781178117811781178117811781178117811781178117811781178

1215121512151215121512151215121512151215121512151215121512151215121512151215121512151215

1225122512251225122512251225122512251225122512251225122512251225122512251225122512251225

12401240124012401240124012401240124012401240124012401240124012401240124012401240124012401460

1460146014601460146014601460146014601460146014601460146014601460146014601460146014601491

149114911491149114911491149114911491149114911491149114911491149114911491149114911491

1624162416241624162416241624162416241624162416241624162416241624162416241624162416241624

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2939293929392939293929392939293929392939293929392939293929392939293929392939293929392939

3184318431843184318431843184318431843184318431843184318431843184318431843184318431843184

Wavenumber (cm-1)1700 1600 1500 1400 1300 1200 1100 1000 900 800 700

%Tr

ansm

ittan

ce

20

30

40

50

60

70

432432432432432432432432432432432432432432432432432432432432432432

642642642642642642642642642642642642642642642642642642642642642642

700700700700700700700700700700700700700700700700700700700700700700

710710710710710710710710710710710710710710710710710710710710710710

810810810810810810810810810810810810810810810810810810810810810810

823823823823823823823823823823823823823823823823823823823823823823

926926926926926926926926926926926926926926926926926926926926926926

1028102810281028102810281028102810281028102810281028102810281028102810281028102810281028

10661066106610661066106610661066106610661066106610661066106610661066106610661066106610661099

109910991099109910991099109910991099109910991099109910991099109910991099109910991099

1178117811781178117811781178117811781178117811781178117811781178117811781178117811781178

1215121512151215121512151215121512151215121512151215121512151215121512151215121512151215

1225122512251225122512251225122512251225122512251225122512251225122512251225122512251225

1240124012401240124012401240124012401240124012401240124012401240124012401240124012401240

1439143914391439143914391439143914391439143914391439143914391439143914391439143914391439

14461446144614461446144614461446144614461446144614461446144614461446144614461446144614461460

1460146014601460146014601460146014601460146014601460146014601460146014601460146014601491

149114911491149114911491149114911491149114911491149114911491149114911491149114911491

1624162416241624162416241624162416241624162416241624162416241624162416241624162416241624

Page 5: CH 3 HC O CH3 N H - SWGDRUG · 2015. 2. 9. · CH3 CH3 3 HC O Form Chemical Formula Molecular Weight Melting Point (oC) Base C15H22N2O 246 Not Determined HCl C15H22N2O. HCl 282 Not

5-Methoxy-diethyltryptamineThe Drug Enforcement Administration's Special Testing and Research Laboratory

generated this monograph using structurally confirmed reference material.

Page 5 of 5SWGDRUG.org/monographs.htmLatest Revision: 1/8/2015

4. ADDITIONAL RESOURCES

No resources identified as of 1/8/15.