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1-methyl-1-cyclohex-2-enecarbonitrile
SpectraBase Compound ID 2O8Mauqsh2X
InChI InChI=1S/C8H11N/c1-8(7-9)5-3-2-4-6-8/h3,5H,2,4,6H2,1H3
InChIKey XMYDLIADJCDVCR-UHFFFAOYSA-N
Mol Weight 121.18 g/mol
Molecular Formula C8H11N
Exact Mass 121.089149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HK7bAWCncrf
Name 1-methyl-1-cyclohex-2-enecarbonitrile
CAS Registry Number 68317-68-0
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H11N
InChI InChI=1S/C8H11N/c1-8(7-9)5-3-2-4-6-8/h3,5H,2,4,6H2,1H3
InChIKey XMYDLIADJCDVCR-UHFFFAOYSA-N
Molecular Weight 121.183 g/mol
SMILES C(#N)C1(C=CCCC1)C
SPLASH splash10-0udi-9200000000-9de4a24effdcee89ca7b
Source of Spectrum J-44-300-0
Synonyms 1-methyl-2-cyclohexene-1-carbonitrile 1-methylcyclohex-2-ene-1-carbonitrile
Wiley ID 1127615