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2-Pentanone, 5-(2-methylenecyclohexyl)-, stereoisomer
SpectraBase Compound ID FPPmFshKkHL
InChI InChI=1S/C12H20O/c1-10-6-3-4-8-12(10)9-5-7-11(2)13/h12H,1,3-9H2,2H3
InChIKey AKULZKYGUDSHMM-UHFFFAOYSA-N
Mol Weight 180.29 g/mol
Molecular Formula C12H20O
Exact Mass 180.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Mj4FjCnbs
Name 2-Pentanone, 5-(2-methylenecyclohexyl)-, stereoisomer
CAS Registry Number 22629-28-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O
InChI InChI=1S/C12H20O/c1-10-6-3-4-8-12(10)9-5-7-11(2)13/h12H,1,3-9H2,2H3
InChIKey AKULZKYGUDSHMM-UHFFFAOYSA-N
Molecular Weight 180.291 g/mol
SMILES C(CC1C(=C)CCCC1)CC(C)=O
SPLASH splash10-0006-9300000000-232511ef060b387016ff
Source of Spectrum SD-1981-0-0
Synonyms 5-(2-Methylenecyclohexyl)-2-pentanone 5-(2-Methylenecyclohexyl)pentan-2-one 5-(2-Methylidenecyclohexyl)pentan-2-one
Wiley ID 1176777