SpectraBase Spectrum ID |
8JiDhfYQUL2 |
Name |
MDAI |
CAS Registry Number |
132741-81-2 |
Classification |
Aminoindane designer drug, entactogen |
Comments |
Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
177.078978596 u |
Formula |
C10H11NO2 |
InChI |
InChI=1S/C10H11NO2/c11-8-1-6-3-9-10(13-5-12-9)4-7(6)2-8/h3-4,8H,1-2,5,11H2 |
InChIKey |
FQDRMHHCWZAXJM-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
177.203 g/mol |
Nominal Mass |
177 u |
Quality |
997 |
Retention Index |
1567 |
SMILES |
NC1CC=2C(=CC3=C(C2)OCO3)C1 |
SPLASH |
splash10-01ta-3900000000-e93c0f5aef8d01cbb4d7 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
5,6-Methylenedioxy-2-aminoindane
6,7-Dihydro-5H-cyclopenta[f][1,3]benzodioxol-6-amine |
Technique |
GC/MS |
Wiley ID |
DD2024_024072 |