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(E)-3-Chloro-3-octenenitrile
SpectraBase Compound ID 99k9RNZ4ZTJ
InChI InChI=1S/C8H12ClN/c1-2-3-4-5-8(9)6-7-10/h5H,2-4,6H2,1H3/b8-5+
InChIKey MNJNZZMGRDEIRX-VMPITWQZSA-N
Mol Weight 157.64 g/mol
Molecular Formula C8H12ClN
Exact Mass 157.065827 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D04GmXY2jmb
Name (E)-3-Chloro-3-octenenitrile
Alternate Name(s) (3E)-3-chloro-3-octenenitrile
Comments Less than 3 mono-isotopic peaks
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Formula C8H12ClN
InChI InChI=1S/C8H12ClN/c1-2-3-4-5-8(9)6-7-10/h5H,2-4,6H2,1H3/b8-5+
InChIKey MNJNZZMGRDEIRX-VMPITWQZSA-N
Molecular Weight 157.644 g/mol
SMILES C(#N)C\C(=C/CCCC)Cl
SPLASH splash10-0a4i-9300000000-6c728b0ecd0ae6c226ad
Source of Spectrum SO-0-728-11
Wiley ID 864343