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4-Hydroxy-5-(1-hydroxy-1-methylethyl)-2-methyl-2-cyclohexen-1-one
SpectraBase Compound ID FYAcwuz29hx
InChI InChI=1S/C10H16O3/c1-6-4-9(12)7(5-8(6)11)10(2,3)13/h4,7,9,12-13H,5H2,1-3H3
InChIKey CTYQZNRISQHJGF-UHFFFAOYSA-N
Mol Weight 184.23 g/mol
Molecular Formula C10H16O3
Exact Mass 184.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2FqxPNDUpjt
Name 4-Hydroxy-5-(1-hydroxy-1-methylethyl)-2-methyl-2-cyclohexen-1-one
CAS Registry Number 97762-02-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O3
InChI InChI=1S/C10H16O3/c1-6-4-9(12)7(5-8(6)11)10(2,3)13/h4,7,9,12-13H,5H2,1-3H3
InChIKey CTYQZNRISQHJGF-UHFFFAOYSA-N
Molecular Weight 184.235 g/mol
SMILES OC(C1C(C=C(C(C1)=O)C)O)(C)C
SPLASH splash10-0a4i-9500000000-95416a747828a68b5ea1
Source of Spectrum W5-1989-35689-29847
Synonyms 2-Methyl-4-oxidanyl-5-(2-oxidanylpropan-2-yl)cyclohex-2-en-1-one 4-Hydroxy-5-(1-hydroxy-1-methyl-ethyl)-2-methyl-cyclohex-2-en-1-one 4-Hydroxy-5-(2-hydroxypropan-2-yl)-2-methyl-1-cyclohex-2-enone 4-Hydroxy-5-(2-hydroxypropan-2-yl)-2-methylcyclohex-2-en-1-one cis-4-Hydroxy-2-methyl-5-(1-hydroxy-1-isopropyl)-2-cyclohexen-1-one
Wiley ID 1180587