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3-(4-Nitrophenyl)-2-propenenitrile
SpectraBase Compound ID Hc2qbhlg1fJ
InChI InChI=1S/C9H6N2O2/c10-7-1-2-8-3-5-9(6-4-8)11(12)13/h1-6H/b2-1+
InChIKey HLFGEWUHBJJYKR-OWOJBTEDSA-N
Mol Weight 174.16 g/mol
Molecular Formula C9H6N2O2
Exact Mass 174.042927 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7tqfMrzKAKD
Name 3-(4-Nitrophenyl)-2-propenenitrile
Comments Less than 3 mono-isotopic peaks
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Formula C9H6N2O2
InChI InChI=1S/C9H6N2O2/c10-7-1-2-8-3-5-9(6-4-8)11(12)13/h1-6H/b2-1+
InChIKey HLFGEWUHBJJYKR-OWOJBTEDSA-N
Molecular Weight 174.159 g/mol
SMILES c1(N(=O)=O)ccc(\C=C\C#N)cc1
SPLASH splash10-0uk9-0900000000-adf6d78bc733974467c9
Source of Spectrum CV-0-41-3
Synonyms 4-Nitrocinnamonitrile (2E)-3-(4-nitrophenyl)-2-propenenitrile (E)-3-(4-nitrophenyl)acrylonitrile (E)-3-(4-nitrophenyl)-2-propenenitrile (E)-3-(4-nitrophenyl)prop-2-enenitrile
Wiley ID 872810