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2,5-Cyclohexadiene-1,4-dione, 3-(1,5-dimethyl-4-hexenyl)-2-hydroxy-5-methyl-, (.+-.)-
SpectraBase Compound ID 3we5NWl7x0l
InChI InChI=1S/C15H20O3/c1-9(2)6-5-7-10(3)13-14(17)11(4)8-12(16)15(13)18/h6,8,10,18H,5,7H2,1-4H3
InChIKey UGYXQNATDGGISC-UHFFFAOYSA-N
Mol Weight 248.32 g/mol
Molecular Formula C15H20O3
Exact Mass 248.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1KvLGaZe5CI
Name 2,5-Cyclohexadiene-1,4-dione, 3-(1,5-dimethyl-4-hexenyl)-2-hydroxy-5-methyl-, (.+-.)-
CAS Registry Number 124175-72-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O3
InChI InChI=1S/C15H20O3/c1-9(2)6-5-7-10(3)13-14(17)11(4)8-12(16)15(13)18/h6,8,10,18H,5,7H2,1-4H3
InChIKey UGYXQNATDGGISC-UHFFFAOYSA-N
Molecular Weight 248.322 g/mol
SMILES OC1=C(C(C(=CC1=O)C)=O)C(CCC=C(C)C)C
SPLASH splash10-014i-7910000000-df861289dc04858210c6
Source of Spectrum J-55-1184-38
Synonyms (+-)-Isoperezone 3-(1,5-dimethyl-4-hexenyl)-2-hydroxy-5-methylbenzo-1,4-quinone
Wiley ID 1251379