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trans-4-Bromo-β-nitrostyrene

View entire compound with spectra: 3 NMR, 2 FTIR, 1 Raman, and 3 MS (GC)

trans-4-Bromo-β-nitrostyrene
SpectraBase Compound ID ITkgPNp9Itz
InChI InChI=1S/C8H6BrNO2/c9-8-3-1-7(2-4-8)5-6-10(11)12/h1-6H/b6-5+
InChIKey LSGVHLGCJIBLMB-AATRIKPKSA-N
Mol Weight 228.04 g/mol
Molecular Formula C8H6BrNO2
Exact Mass 226.958191 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3f1PqF7lbBy
Name 1-Bromanyl-4-[(E)-2-nitroethenyl]benzene
Alternate Name(s) 1-Bromo-4-[(E)-2-nitroethenyl]benzene 1-Bromo-4-(2-nitrovinyl)benzene 1-Bromo-4-[(E)-2-nitrovinyl]benzene 4-Bromo-.beta.-nitrostyrene
CAS Registry Number 3156-37-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6BrNO2
InChI InChI=1S/C8H6BrNO2/c9-8-3-1-7(2-4-8)5-6-10(11)12/h1-6H/b6-5+
InChIKey LSGVHLGCJIBLMB-AATRIKPKSA-N
Molecular Weight 228.045 g/mol
SMILES c1cc(\C=C\N(=O)=O)ccc1Br
SPLASH splash10-0udi-9600000000-35fd63384f4fa5235652
Source of Spectrum AD-0-2532-0
Wiley ID 1429026