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4-(2-formylcyclohex-1-en-1-yl)benzonitrile
SpectraBase Compound ID DKmgc6HfGpi
InChI InChI=1S/C14H13NO/c15-9-11-5-7-12(8-6-11)14-4-2-1-3-13(14)10-16/h5-8,10H,1-4H2
InChIKey OZVMDGGXVRKADV-UHFFFAOYSA-N
Mol Weight 211.26 g/mol
Molecular Formula C14H13NO
Exact Mass 211.099714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FDRCVEGQnh4
Name 4-(2-formylcyclohex-1-en-1-yl)benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13NO
InChI InChI=1S/C14H13NO/c15-9-11-5-7-12(8-6-11)14-4-2-1-3-13(14)10-16/h5-8,10H,1-4H2
InChIKey OZVMDGGXVRKADV-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201302058
Molecular Weight 211.264 g/mol
SMILES c1(ccc(C#N)cc1)C1=C(CCCC1)C=O
SPLASH splash10-03di-0590000000-7aeb414447d71a512ce4
Source of Spectrum ACI-52-SMS7-4a
Synonyms 6'-formyl-2',3',4',5'-tetrahydro-[1,1'-biphenyl]-4-carbonitrile
Wiley ID 1781428