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(E)-2-((2-bromo-2-cyclononenyl)methyl)acrylonitrile
SpectraBase Compound ID Tj8PMjYn4j
InChI InChI=1S/C13H18BrN/c1-11(10-15)9-12-7-5-3-2-4-6-8-13(12)14/h8,12H,1-7,9H2/b13-8+
InChIKey MIBDTXKLLSPWGL-MDWZMJQESA-N
Mol Weight 268.2 g/mol
Molecular Formula C13H18BrN
Exact Mass 267.062263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9AnxQqdWQcW
Name (E)-2-((2-bromo-2-cyclononenyl)methyl)acrylonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18BrN
InChI InChI=1S/C13H18BrN/c1-11(10-15)9-12-7-5-3-2-4-6-8-13(12)14/h8,12H,1-7,9H2/b13-8+
InChIKey MIBDTXKLLSPWGL-MDWZMJQESA-N
Literature Reference DOI 10.1021/ol201395p
Molecular Weight 268.198 g/mol
SMILES C1CCCC(\C(=C/CC1)Br)CC(C#N)=C
SPLASH splash10-000i-3910000000-dcf1e8494c86096c3760
Source of Spectrum A1-13-3864/SMS17-3l
Synonyms (E)-2-((2-bromocyclonon-2-en-1-yl)methyl)acrylonitrile
Wiley ID 1753514