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Ethanone, 1-[5-hydroxy-2,2-dimethyl-1-(3-methyl-1,3-butadienyl)cyclopentyl]-, [1.alpha.,1(Z),5.alpha.]-
SpectraBase Compound ID 4X1vJPUlZKA
InChI InChI=1S/C14H22O2/c1-10(2)6-9-14(11(3)15)12(16)7-8-13(14,4)5/h6,9,12,16H,1,7-8H2,2-5H3/b9-6-/t12-,14-/m0/s1
InChIKey UHTGGJMTUFRKTF-QKXHPSOXSA-N
Mol Weight 222.33 g/mol
Molecular Formula C14H22O2
Exact Mass 222.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Zhg6JvCu9m
Name Ethanone, 1-[5-hydroxy-2,2-dimethyl-1-(3-methyl-1,3-butadienyl)cyclopentyl]-, [1.alpha.,1(Z),5.alpha.]-
CAS Registry Number 81052-56-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O2
InChI InChI=1S/C14H22O2/c1-10(2)6-9-14(11(3)15)12(16)7-8-13(14,4)5/h6,9,12,16H,1,7-8H2,2-5H3/b9-6-/t12-,14-/m0/s1
InChIKey UHTGGJMTUFRKTF-QKXHPSOXSA-N
Molecular Weight 222.328 g/mol
SMILES O[C@@]1([C@@](\C=C/C(=C)C)(C(CC1)(C)C)C(=O)C)[H]
SPLASH splash10-0007-9550000000-ed4207247f09bd9f5890
Source of Spectrum F-37-3342-0
Synonyms (1R*,5S*)-(1-[(Z)-3'-methyl-1',3'-butadienyl]-5-hydroxy-2,2-dimethylcyclopentyl) methyl ketone 1-{(1R,5S)-5-hydroxy-2,2-dimethyl-1-[(1Z)-3-methyl-1,3-butadienyl]cyclopentyl}ethanone
Wiley ID 1222796