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Acetic acid, 7-chloro-1,3-dimethyl-6-oxohept-2-enyl ester
SpectraBase Compound ID KRW4YNoNpVL
InChI InChI=1S/C11H17ClO3/c1-8(4-5-11(14)7-12)6-9(2)15-10(3)13/h6,9H,4-5,7H2,1-3H3/b8-6+
InChIKey AZZMODFYJJFOJP-SOFGYWHQSA-N
Mol Weight 232.71 g/mol
Molecular Formula C11H17ClO3
Exact Mass 232.086622 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DqOnMdDT1bl
Name ACETIC ACID, 7-CHLORO-1,3-DIMETHYL-6-OXO-HEPT-2-ENYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H17O3Cl
InChI InChI=1S/C11H17ClO3/c1-8(4-5-11(14)7-12)6-9(2)15-10(3)13/h6,9H,4-5,7H2,1-3H3/b8-6+
InChIKey AZZMODFYJJFOJP-SOFGYWHQSA-N
Molecular Weight 232.0862
SMILES CC(OC(\C=C\(CCC(CCl)=O)C)C)=O
SPLASH splash10-0007-9200000000-40ee88ad299cb5af1824
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany