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2-Cyclopenten-1-one, 5-(2,3-dihydroxy-3-methylbutyl)-3,4-dihydroxy-2-(3-methyl-1-oxobutyl) -4-(4-methyl-1-oxo-3-pentenyl)-

View entire compound with spectra: 1 MS (GC)

2-Cyclopenten-1-one, 5-(2,3-dihydroxy-3-methylbutyl)-3,4-dihydroxy-2-(3-methyl-1-oxobutyl) -4-(4-methyl-1-oxo-3-pentenyl)-
SpectraBase Compound ID BZuxsYgHiEN
InChI InChI=1S/C21H32O7/c1-11(2)7-8-15(23)21(28)13(10-16(24)20(5,6)27)18(25)17(19(21)26)14(22)9-12(3)4/h7,12-13,16,24,26-28H,8-10H2,1-6H3
InChIKey GLBVJKXQGWTLKH-UHFFFAOYSA-N
Mol Weight 396.5 g/mol
Molecular Formula C21H32O7
Exact Mass 396.214803 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0DknIbt21Y
Name 2-Cyclopenten-1-one, 5-(2,3-dihydroxy-3-methylbutyl)-3,4-dihydroxy-2-(3-methyl-1-oxobutyl) -4-(4-methyl-1-oxo-3-pentenyl)-
Alternate Name(s) 1-(3-Methylbutanoyl)-2,3-dihydroxy-3-(4-methyl-3-pentenoyl)-4-(3-methyl-2,3-dihydroxybutyl)cyclopent-1-en-5-one 5-(2,3-dihydroxy-3-methylbutyl)-3,4-dihydroxy-2-(3-methylbutanoyl)-4-(4-methyl-3-pentenoyl)-2-cyclopenten-1-one
CAS Registry Number 81677-93-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O7
InChI InChI=1S/C21H32O7/c1-11(2)7-8-15(23)21(28)13(10-16(24)20(5,6)27)18(25)17(19(21)26)14(22)9-12(3)4/h7,12-13,16,24,26-28H,8-10H2,1-6H3
InChIKey GLBVJKXQGWTLKH-UHFFFAOYSA-N
Molecular Weight 396.480 g/mol
SMILES OC1(C(=C(C(C1CC(C(O)(C)C)O)=O)C(CC(C)C)=O)O)C(CC=C(C)C)=O
SPLASH splash10-07vi-9013000000-2bddeedd68764327e2ee
Source of Spectrum KC-1982-382-0
Wiley ID 1367424