SpectraBase Spectrum ID |
DmTUhrOwkMa |
Name |
2-(3,4-Methylenedioxyphenyl)butan-1-amine AC |
Classification |
beta-isomeric phenylbutanamine designer drug derivative |
Comments |
Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
235.120843408 u |
Formula |
C13H17NO3 |
InChI |
InChI=1S/C13H17NO3/c1-3-10(7-14-9(2)15)11-4-5-12-13(6-11)17-8-16-12/h4-6,10H,3,7-8H2,1-2H3,(H,14,15) |
InChIKey |
HNNWAOGGXRSSCD-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
235.283 g/mol |
Nominal Mass |
235 u |
Quality |
933 |
Retention Index |
1839 |
SMILES |
C=1(C(CNC(=O)C)CC)C=C2C(=CC1)OCO2 |
SPLASH |
splash10-004i-0900000000-93cdeec352386cf6e67f |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
N-(2-(1,3-benzodioxol-5-yl)butyl)acetamide |
Technique |
GC/MS |
Wiley ID |
DD2024_002186 |