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U-47931E-A (-2H)
SpectraBase Compound ID 6hIWTrbn3fr
InChI InChI=1S/C15H19BrN2O/c1-18(2)14-6-4-3-5-13(14)17-15(19)11-7-9-12(16)10-8-11/h7-10,14H,3-6H2,1-2H3/b17-13+/t14-/m0/s1
InChIKey YNPWMHQMMAGMAX-DLRWLJPMSA-N
Mol Weight 323.23 g/mol
Molecular Formula C15H19BrN2O
Exact Mass 322.068076 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2kjWw6AjTVI
Name U-47931E-A (-2H)
Classification Benzamide opioid designer drug artifact
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 322.068076239 u
Formula C15H19BrN2O
InChI InChI=1S/C15H19BrN2O/c1-18(2)14-6-4-3-5-13(14)17-15(19)11-7-9-12(16)10-8-11/h7-10,14H,3-6H2,1-2H3/b17-13+/t14-/m0/s1
InChIKey YNPWMHQMMAGMAX-DLRWLJPMSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 323.234 g/mol
Nominal Mass 322 u
Quality 903
Retention Index 2329
SMILES [C@]1(\C(CCCC1)=N\C(C1=CC=C(C=C1)Br)=O)(N(C)C)[H]
SPLASH splash10-0080-5932000000-c94f5f8a99b5bf62e0d3
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-bromo-N-((1E,2S)-2-(dimethylamino)cyclohexylidene)benzamide
Technique GC/MS
Wiley ID DD2024_025493