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2-(1-Azepino)-4'-methylacetophenone
SpectraBase Compound ID A1Dw22IE2xP
InChI InChI=1S/C15H21NO/c1-13-6-8-14(9-7-13)15(17)12-16-10-4-2-3-5-11-16/h6-9H,2-5,10-12H2,1H3
InChIKey AJJNHVCBFOXXBU-UHFFFAOYSA-N
Mol Weight 231.34 g/mol
Molecular Formula C15H21NO
Exact Mass 231.162314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CZ9IRWWioSk
Name 2-(1-Azepino)-4'-methylacetophenone
Classification Cathinone analog designer drug
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 231.162314299 u
Formula C15H21NO
InChI InChI=1S/C15H21NO/c1-13-6-8-14(9-7-13)15(17)12-16-10-4-2-3-5-11-16/h6-9H,2-5,10-12H2,1H3
InChIKey AJJNHVCBFOXXBU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 231.339 g/mol
Nominal Mass 231 u
Quality 987
Retention Index 1920
SMILES C(C=1C=CC(=CC1)C)(CN1CCCCCC1)=O
SPLASH splash10-03di-3900000000-688c628f6d63e5096bd3
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2-(azepan-1-yl)-1-(4-methylphenyl)ethan-1-one
Technique GC/MS
Wiley ID DD2024_012866