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

*Links on SpectraBase are not permalinks.
Etonitazene
SpectraBase Compound ID KhWOsonhxIU
InChI InChI=1S/C22H28N4O3/c1-4-24(5-2)13-14-25-21-12-9-18(26(27)28)16-20(21)23-22(25)15-17-7-10-19(11-8-17)29-6-3/h7-12,16H,4-6,13-15H2,1-3H3
InChIKey PXDBZSCGSQSKST-UHFFFAOYSA-N
Mol Weight 396.49 g/mol
Molecular Formula C22H28N4O3
Exact Mass 396.216141 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 JFFQgj3dUZs
Name Etonitazene
CAS Registry Number 911-65-9
Classification Nitazene opioid designer drug
Comments Spectrum verified by crosschecking against external libraries (one 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 396.216140775 u
Formula C22H28N4O3
InChI InChI=1S/C22H28N4O3/c1-4-24(5-2)13-14-25-21-12-9-18(26(27)28)16-20(21)23-22(25)15-17-7-10-19(11-8-17)29-6-3/h7-12,16H,4-6,13-15H2,1-3H3
InChIKey PXDBZSCGSQSKST-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 396.491 g/mol
Nominal Mass 396 u
Quality 946
Retention Index 3359
SMILES C=12N(C(=NC2=CC(=CC1)[N+](=O)[O-])CC=1C=CC(=CC1)OCC)CCN(CC)CC
SPLASH splash10-000i-9100000000-8330719b8de3a6638d48
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-[2-[2-[(4-Ethoxyphenyl)methyl]-5-nitro-benzoimidazol-1-yl]ethyl]-N-ethyl-ethanamine
Technique GC/MS
Wiley ID DD2024_014151