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1-Phenyl-2-nitrobut-1-ene
SpectraBase Compound ID HEOJ9fCGNE0
InChI InChI=1S/C10H11NO2/c1-2-10(11(12)13)8-9-6-4-3-5-7-9/h3-8H,2H2,1H3/b10-8-
InChIKey ZWVYQTKQQAYACO-NTMALXAHSA-N
Mol Weight 177.2 g/mol
Molecular Formula C10H11NO2
Exact Mass 177.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8KJy5YRMOhs
Name 1-Phenyl-2-nitrobut-1-ene
Classification Designer drug precursor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 177.078978596 u
Formula C10H11NO2
InChI InChI=1S/C10H11NO2/c1-2-10(11(12)13)8-9-6-4-3-5-7-9/h3-8H,2H2,1H3/b10-8-
InChIKey ZWVYQTKQQAYACO-NTMALXAHSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 177.203 g/mol
Nominal Mass 177 u
Quality 990
Retention Index 1463
SMILES C=1(\C=C\([N+](=O)[O-])CC)C=CC=CC1
SPLASH splash10-016u-9700000000-0af546a312941c5862cf
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms (2-nitrobut-1-en-1-yl)benzene
Technique GC/MS
Wiley ID DD2024_005334