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2-(o-Bromobenzyl)-3-pentenenitrile

View entire compound with spectra: 1 MS (GC)

2-(o-Bromobenzyl)-3-pentenenitrile
SpectraBase Compound ID H58k77kxGhO
InChI InChI=1S/C12H12BrN/c1-2-5-10(9-14)8-11-6-3-4-7-12(11)13/h2-7,10H,8H2,1H3/b5-2+
InChIKey RPDKZBPXELMVEZ-GORDUTHDSA-N
Mol Weight 250.14 g/mol
Molecular Formula C12H12BrN
Exact Mass 249.015312 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GOaatPXRtQV
Name 2-(o-Bromobenzyl)-3-pentenenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12BrN
InChI InChI=1S/C12H12BrN/c1-2-5-10(9-14)8-11-6-3-4-7-12(11)13/h2-7,10H,8H2,1H3/b5-2+
InChIKey RPDKZBPXELMVEZ-GORDUTHDSA-N
Molecular Weight 250.139 g/mol
SMILES C(#N)C(Cc1c(Br)cccc1)\C=C\C
SPLASH splash10-01b9-2910000000-33258124dbfbec9cce07
Source of Spectrum QA-47-334-2
Synonyms (3E)-2-(2-bromobenzyl)-3-pentenenitrile
Wiley ID 863337