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2-(1-hydroxybutyl)-3,5,5-trimethyl-1-cyclohex-3-enone
SpectraBase Compound ID JnbqWwVKs11
InChI InChI=1S/C13H22O2/c1-5-6-10(14)12-9(2)7-13(3,4)8-11(12)15/h7,10,12,14H,5-6,8H2,1-4H3
InChIKey RNPWTYBAFGCESX-UHFFFAOYSA-N
Mol Weight 210.32 g/mol
Molecular Formula C13H22O2
Exact Mass 210.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9M9CmAICv21
Name 2-(1-hydroxybutyl)-3,5,5-trimethyl-1-cyclohex-3-enone
Alternate Name(s) 2-(1-hydroxybutyl)-3,5,5-trimethyl-cyclohex-3-en-1-one 3,5,5-trimethyl-2-(1-oxidanylbutyl)cyclohex-3-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O2
InChI InChI=1S/C13H22O2/c1-5-6-10(14)12-9(2)7-13(3,4)8-11(12)15/h7,10,12,14H,5-6,8H2,1-4H3
InChIKey RNPWTYBAFGCESX-UHFFFAOYSA-N
Molecular Weight 210.317 g/mol
SMILES OC(C1C(=O)CC(C=C1C)(C)C)CCC
SPLASH splash10-05vo-3900000000-456ad85eefa5befb94cf
Source of Spectrum KC-0-2401-8
Wiley ID 786451