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Cyclohexanone, 2-(2-butenyl)-2-methyl-5-(1-methylethenyl)-, [2.alpha.(E),4.alpha.]-
SpectraBase Compound ID 2nSFAPcmilm
InChI InChI=1S/C14H22O/c1-5-6-8-14(4)9-7-12(11(2)3)10-13(14)15/h5-6,12H,2,7-10H2,1,3-4H3/b6-5+/t12?,14-/m0/s1
InChIKey MLXNXJFEEMAXLJ-PNCSUMMDSA-N
Mol Weight 206.33 g/mol
Molecular Formula C14H22O
Exact Mass 206.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7BnKDUwEt6S
Name Cyclohexanone, 2-(2-butenyl)-2-methyl-5-(1-methylethenyl)-, [2.alpha.(E),4.alpha.]-
CAS Registry Number 53142-05-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O
InChI InChI=1S/C14H22O/c1-5-6-8-14(4)9-7-12(11(2)3)10-13(14)15/h5-6,12H,2,7-10H2,1,3-4H3/b6-5+/t12?,14-/m0/s1
InChIKey MLXNXJFEEMAXLJ-PNCSUMMDSA-N
Molecular Weight 206.329 g/mol
SMILES C1([C@](CCC(C1)C(=C)C)(C\C=C\C)C)=O
SPLASH splash10-0a4i-0920000000-ffdbe8903b820f928fa0
Source of Spectrum J-40-101-0
Synonyms (2R)-2-[(2E)-2-butenyl]-5-isopropenyl-2-methylcyclohexanone [2.alpha.(E),4.alpha.]-2-(2-butenyl)-2-methyl-5-(1-methylethenyl)cyclohexanone
Wiley ID 1205028