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3,5-Dihydroxy-4,4-dimethyl-2,5-cyclohexadien-1-one
SpectraBase Compound ID 9qkGayoZAHK
InChI InChI=1S/C8H10O3/c1-8(2)6(10)3-5(9)4-7(8)11/h3-4,10-11H,1-2H3
InChIKey ZITLVRQXJUFZOO-UHFFFAOYSA-N
Mol Weight 154.16 g/mol
Molecular Formula C8H10O3
Exact Mass 154.062994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 445m1FHTLmC
Name 3,5-Dihydroxy-4,4-dimethyl-2,5-cyclohexadien-1-one
Alternate Name(s) 2,2-Dimethylcyclohexane-1,3,5-trione 2,5-Cyclohexadien-1-one, 3,5-dihydroxy-4,4-dimethyl- Filicinic acid EINECS 218-175-9
CAS Registry Number 2065-00-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H10O3
InChI InChI=1S/C8H10O3/c1-8(2)6(10)3-5(9)4-7(8)11/h3-4,10-11H,1-2H3
InChIKey ZITLVRQXJUFZOO-UHFFFAOYSA-N
Molecular Weight 154.165 g/mol
SMILES OC=1C(C(=CC(C1)=O)O)(C)C
SPLASH splash10-006x-9100000000-61aeb4657fef4352a33f
Source of Spectrum CD-572-0-0
Wiley ID 1150991