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Acetic acid, 7-chloro-3-methyl-6-oxo-hept-2-enyl ester
SpectraBase Compound ID 9xdfoUC0OsD
InChI InChI=1S/C10H15ClO3/c1-8(3-4-10(13)7-11)5-6-14-9(2)12/h5H,3-4,6-7H2,1-2H3/b8-5+
InChIKey HLSFNJSOMTWUQG-VMPITWQZSA-N
Mol Weight 218.68 g/mol
Molecular Formula C10H15ClO3
Exact Mass 218.070972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3XVGPtuJaNt
Name ACETIC ACID, 7-CHLORO-3-METHYL-6-OXO-HEPT-2-ENYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H15O3Cl
InChI InChI=1S/C10H15ClO3/c1-8(3-4-10(13)7-11)5-6-14-9(2)12/h5H,3-4,6-7H2,1-2H3/b8-5+
InChIKey HLSFNJSOMTWUQG-VMPITWQZSA-N
Molecular Weight 218.0706
SMILES C(Cl)C(CC\C(=C\COC(C)=O)C)=O
SPLASH splash10-000x-9200000000-395ee30ed996751608fe
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany