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3-[1-methyl-2-(hydroxymethyl)-4-oxo-cylopent-2-enyl]-6-hydroxy-3,6-dimethylcyclohexene
SpectraBase Compound ID EiGU3w4egeU
InChI InChI=1S/C15H22O3/c1-13(4-6-14(2,18)7-5-13)15(3)9-12(17)8-11(15)10-16/h4,6,8,16,18H,5,7,9-10H2,1-3H3
InChIKey MKMOUQVTTUPKSO-UHFFFAOYSA-N
Mol Weight 250.34 g/mol
Molecular Formula C15H22O3
Exact Mass 250.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6PcavXsCCcf
Name 3-[1-methyl-2-(hydroxymethyl)-4-oxo-cylopent-2-enyl]-6-hydroxy-3,6-dimethylcyclohexene
Alternate Name(s) 4-(4-hydroxy-1,4-dimethyl-2-cyclohexen-1-yl)-3-(hydroxymethyl)-4-methyl-2-cyclopenten-1-one
CAS Registry Number 122470-41-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-13(4-6-14(2,18)7-5-13)15(3)9-12(17)8-11(15)10-16/h4,6,8,16,18H,5,7,9-10H2,1-3H3
InChIKey MKMOUQVTTUPKSO-UHFFFAOYSA-N
Molecular Weight 250.338 g/mol
SMILES OCC=1C(C2(CCC(C=C2)(O)C)C)(CC(C1)=O)C
SPLASH splash10-0a7i-4900000000-62d596c7a7ded25dbebf
Source of Spectrum J-54-4317-11
Wiley ID 1253666