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Butonitazene-A (-C2H5)
SpectraBase Compound ID 6tbMNtVDwVN
InChI InChI=1S/C22H28N4O3/c1-3-5-14-29-19-9-6-17(7-10-19)15-22-24-20-16-18(26(27)28)8-11-21(20)25(22)13-12-23-4-2/h6-11,16,23H,3-5,12-15H2,1-2H3
InChIKey TXNJICNCQHNNIA-UHFFFAOYSA-N
Mol Weight 396.49 g/mol
Molecular Formula C22H28N4O3
Exact Mass 396.216141 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5jCBWkVpWZ8
Name Butonitazene-A (-C2H5)
Classification Nitazene opioid designer drug artifact
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 396.216140775 u
Formula C22H28N4O3
InChI InChI=1S/C22H28N4O3/c1-3-5-14-29-19-9-6-17(7-10-19)15-22-24-20-16-18(26(27)28)8-11-21(20)25(22)13-12-23-4-2/h6-11,16,23H,3-5,12-15H2,1-2H3
InChIKey TXNJICNCQHNNIA-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 396.491 g/mol
Nominal Mass 396 u
Quality 986
Retention Index 3189
SMILES C=12N(C(=NC2=CC(=CC1)[N+](=O)[O-])CC1=CC=C(C=C1)OCCCC)CCNCC
SPLASH splash10-08fr-4911000000-3777b11f7ff394dfc941
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2-(2-(4-butoxybenzyl)-5-nitro-1H-benzimidazol-1-yl)-N-ethylethan-1-amine
Technique GC/MS
Wiley ID DD2024_032752