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cis-Dihydro-juvabione
SpectraBase Compound ID 9mUQ27772Yc
InChI InChI=1S/C16H28O3/c1-11(2)9-15(17)10-12(3)13-5-7-14(8-6-13)16(18)19-4/h11-14H,5-10H2,1-4H3
InChIKey ZPCDXXMKLPRLRL-UHFFFAOYSA-N
Mol Weight 268.4 g/mol
Molecular Formula C16H28O3
Exact Mass 268.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5wa170SN3vX
Name Cyclohexanecarboxylic acid, 4-(1,5-dimethyl-3-oxohexyl)-, methyl ester, cis-
Alternate Name(s) Methyl 4-(1,5-dimethyl-3-oxohexyl)cyclohexanecarboxylate 4-(3-keto-1,5-dimethyl-hexyl)cyclohexanecarboxylic acid methyl ester 4-(6-Methyl-4-oxoheptan-2-yl)-1-cyclohexanecarboxylic acid methyl ester Methyl 4-(6-methyl-4-oxidanylidene-heptan-2-yl)cyclohexane-1-carboxylate Methyl 4-(6-methyl-4-oxoheptan-2-yl)cyclohexane-1-carboxylate
CAS Registry Number 17904-29-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O3
InChI InChI=1S/C16H28O3/c1-11(2)9-15(17)10-12(3)13-5-7-14(8-6-13)16(18)19-4/h11-14H,5-10H2,1-4H3
InChIKey ZPCDXXMKLPRLRL-UHFFFAOYSA-N
Molecular Weight 268.397 g/mol
SMILES C(C(C)C1CCC(CC1)C(OC)=O)C(CC(C)C)=O
SPLASH splash10-0a4i-9500000000-ca026a28f0514ccddf59
Source of Spectrum EP-3359-0-0
Wiley ID 1272393