SpectraBase Spectrum ID |
2nnyAE59xLs |
Name |
3,4-Methylenedioxyphenethylamine |
CAS Registry Number |
1484-85-1 |
Classification |
Phenethylamine designer drug |
Comments |
Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
165.078978596 u |
Formula |
C9H11NO2 |
InChI |
InChI=1S/C9H11NO2/c10-4-3-7-1-2-8-9(5-7)12-6-11-8/h1-2,5H,3-4,6,10H2 |
InChIKey |
RRIRDPSOCUCGBV-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
165.192 g/mol |
Nominal Mass |
165 u |
Quality |
989 |
Retention Index |
1303 |
SMILES |
NCCC=1C=C2C(=CC1)OCO2 |
SPLASH |
splash10-0019-9800000000-e780aa0c712cfb1ffb17 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
MDPEA |
Technique |
GC/MS |
Wiley ID |
DD2024_031279 |