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1-[(1R,3S)-1-Methyl-3-(1-methylethenyl)cyclopent-1-yl]prop-2-en-1-one
SpectraBase Compound ID 8k3RbtCPHeA
InChI InChI=1S/C12H18O/c1-5-11(13)12(4)7-6-10(8-12)9(2)3/h5,10H,1-2,6-8H2,3-4H3/t10-,12+/m0/s1
InChIKey LEGRUCXBPSXDMQ-CMPLNLGQSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HzDv0Vuesu6
Name 1-[(1R,3S)-1-Methyl-3-(1-methylethenyl)cyclopent-1-yl]prop-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-5-11(13)12(4)7-6-10(8-12)9(2)3/h5,10H,1-2,6-8H2,3-4H3/t10-,12+/m0/s1
InChIKey LEGRUCXBPSXDMQ-CMPLNLGQSA-N
Literature Reference DOI 10.1002/hlca.200490180
Molecular Weight 178.275 g/mol
SMILES C[C@]1(CC[C@](C(C)=C)(C1)[H])C(C=C)=O
SPLASH splash10-05ai-9300000000-faef706dd13f1629b1b1
Source of Spectrum H-87-2019-24
Synonyms 1-((1R,3S)-1-methyl-3-(prop-1-en-2-yl)cyclopentyl)prop-2-en-1-one
Wiley ID 1785557