For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
MDAI N-3-methylbenzyl
SpectraBase Compound ID JsxP1ivdofp
InChI InChI=1S/C18H19NO2/c1-12-3-2-4-13(5-12)10-19-16-6-14-8-17-18(21-11-20-17)9-15(14)7-16/h2-5,8-9,16,19H,6-7,10-11H2,1H3
InChIKey CMJDDHZYROILPJ-UHFFFAOYSA-N
Mol Weight 281.36 g/mol
Molecular Formula C18H19NO2
Exact Mass 281.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2pTLvFPasFs
Name MDAI N-3-methylbenzyl
Classification Aminoindane 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 281.141578854 u
Formula C18H19NO2
InChI InChI=1S/C18H19NO2/c1-12-3-2-4-13(5-12)10-19-16-6-14-8-17-18(21-11-20-17)9-15(14)7-16/h2-5,8-9,16,19H,6-7,10-11H2,1H3
InChIKey CMJDDHZYROILPJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 281.355 g/mol
Nominal Mass 281 u
Quality 999
Retention Index 2419
SMILES C1=2C(CC(NCC=3C=C(C=CC3)C)C1)=CC1=C(C2)OCO1
SPLASH splash10-0k9t-3910000000-866129160ea9ba02fe89
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(3-Methylbenzyl)-6,7-dihydro-2H,5H-indeno[5,6-d][1,3]dioxol-6-amine
Technique GC/MS
Wiley ID DD2024_030173