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2-Cyclohexene-1-acetonitrile, 6-methyl-4-oxo-, trans-
SpectraBase Compound ID Fs1ve7GAlMg
InChI InChI=1S/C9H11NO/c1-7-6-9(11)3-2-8(7)4-5-10/h2-3,7-8H,4,6H2,1H3/t7-,8+/m1/s1
InChIKey VRYYBAZNMPTXPW-SFYZADRCSA-N
Mol Weight 149.19 g/mol
Molecular Formula C9H11NO
Exact Mass 149.084064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9kn2rdPUhSs
Name 2-Cyclohexene-1-acetonitrile, 6-methyl-4-oxo-, trans-
CAS Registry Number 130472-16-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11NO
InChI InChI=1S/C9H11NO/c1-7-6-9(11)3-2-8(7)4-5-10/h2-3,7-8H,4,6H2,1H3/t7-,8+/m1/s1
InChIKey VRYYBAZNMPTXPW-SFYZADRCSA-N
Molecular Weight 149.193 g/mol
SMILES C(#N)C[C@@]1(C=CC(C[C@]1(C)[H])=O)[H]
SPLASH splash10-0a6r-9300000000-fa5f25615a11654a895e
Source of Spectrum KC-1990-1396-22
Synonyms (4R(*),5R(*))-4-cyanomethyl-5-methylcyclohex-2-enone [(1S,6R)-6-methyl-4-oxo-2-cyclohexen-1-yl]acetonitrile
Wiley ID 1146338