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Cinerin I
SpectraBase Compound ID 8h9MibNp7VV
InChI InChI=1S/C20H28O3/c1-7-8-9-14-13(4)17(11-16(14)21)23-19(22)18-15(10-12(2)3)20(18,5)6/h7-8,10,15,17-18H,9,11H2,1-6H3/b8-7-/t15-,17?,18?/m1/s1
InChIKey FMTFEIJHMMQUJI-FWEZWFLBSA-N
Mol Weight 316.44 g/mol
Molecular Formula C20H28O3
Exact Mass 316.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L851varSb2b
Name Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, 3-(2-butenyl)-2-methyl-4-oxo-2-cyclopenten-1-yl ester, [1R-[1.alpha.[S*(Z)],3.beta.]]-
CAS Registry Number 25402-06-6
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O3
InChI InChI=1S/C20H28O3/c1-7-8-9-14-13(4)17(11-16(14)21)23-19(22)18-15(10-12(2)3)20(18,5)6/h7-8,10,15,17-18H,9,11H2,1-6H3/b8-7-/t15-,17?,18?/m1/s1
InChIKey FMTFEIJHMMQUJI-FWEZWFLBSA-N
Molecular Weight 316.441 g/mol
SMILES C1([C@](C=C(C)C)(C1C(OC1C(=C(C\C=C/C)C(C1)=O)C)=O)[H])(C)C
SPLASH splash10-00di-6900000000-2ec2fd80b9adf3eaca14
Source of Spectrum AD-0-2256-0
Synonyms 2,2-Dimethyl-3-(2-methyl-1-propenyl)cyclopropanecarboxylic acid 3-(2-butyl)- 2-methyl-4-oxo-2-cyclopenten-1-yl-ester 3-(2-Butenyl)-2-methyl-4-oxo-2-cyclopenten-1-yl 2,2-dimethyl-3-(2-methyl-1-propenyl)cyclopropanecarboxylate (1R-(1alpha(S*(Z)),3beta))- 3-(but-2-enyl)-2-methyl-4-oxocyclopent-2-enyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylate Chrysanthemummonocarboxilic acid, 3-(2-butenyl)-2-methyl-4-oxo-2-cyclopenten-1-yl ester Chrysanthemummonocarboxylic acid, cinerolone ester Cinerin Cinerin I Cinerine I Cinerolone, chrysanthemummonocarboxylic acid ester Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, 3-(2-butenyl)-2-methyl-4-oxo-2-cyclopenten-1-yl ester Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methylpropenyl)-, ester with 2-(2-butenyl)-4-hydroxy-3-methyl-2-cyclopenten-1-one EINECS 246-948-0 HSDB 6837
Wiley ID 47188