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(E)-4-(1'-HYDROXY-2',2'-DIMETHYL-6'-METHYLIDENECYCLOHEXYL)-PENT-3-EN-2-ONE
SpectraBase Compound ID 1CravJ1nPJf
InChI InChI=1S/C14H22O2/c1-10-7-6-8-13(4,5)14(10,16)11(2)9-12(3)15/h9,16H,1,6-8H2,2-5H3/b11-9+
InChIKey FHMORFWELLTUIM-PKNBQFBNSA-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 6SJPqKKRwaD
Name 3-Penten-2-one, 4-(1-hydroxy-2,2-dimethyl-6-methylenecyclohexyl)-, (E)-(.+-.)-
Alternate Name(s) (3E)-4-(1-hydroxy-2,2-dimethyl-6-methylenecyclohexyl)-3-penten-2-one (E)-4-(1'-hydroperoxy-2',2'-dimethyl-6'-methylidenecyclohexyl)pent-3-en-2-one
CAS Registry Number 125257-59-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O2
InChI InChI=1S/C14H22O2/c1-10-7-6-8-13(4,5)14(10,16)11(2)9-12(3)15/h9,16H,1,6-8H2,2-5H3/b11-9+
InChIKey FHMORFWELLTUIM-PKNBQFBNSA-N
Molecular Weight 222.328 g/mol
SMILES OC1(\C(=C\C(=O)C)C)C(=C)CCCC1(C)C
SPLASH splash10-0006-7900000000-f8427efec184d3610065
Source of Spectrum H-72-950-0
Wiley ID 1222917