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3-Cyclohexene-1-propanoic acid, .alpha.,.alpha.-dichloro-, ethyl ester, (.+-.)-
SpectraBase Compound ID 7a8A9mJcFnK
InChI InChI=1S/C11H16Cl2O2/c1-2-15-10(14)11(12,13)8-9-6-4-3-5-7-9/h3-4,9H,2,5-8H2,1H3
InChIKey LJIFSBAUMSHQQV-UHFFFAOYSA-N
Mol Weight 251.15 g/mol
Molecular Formula C11H16Cl2O2
Exact Mass 250.052735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H1iCu5eYiSW
Name 3-Cyclohexene-1-propanoic acid, .alpha.,.alpha.-dichloro-, ethyl ester, (.+-.)-
CAS Registry Number 115119-79-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16Cl2O2
InChI InChI=1S/C11H16Cl2O2/c1-2-15-10(14)11(12,13)8-9-6-4-3-5-7-9/h3-4,9H,2,5-8H2,1H3
InChIKey LJIFSBAUMSHQQV-UHFFFAOYSA-N
Molecular Weight 251.153 g/mol
SMILES C(C(=O)OCC)(CC1CC=CCC1)(Cl)Cl
SPLASH splash10-003s-9000000000-0dd15c3ea5d7b6f1c7af
Source of Spectrum C-110-5539-4
Synonyms Ethyl 2,2-dichloro-3-(3-cyclohexen-1-yl)propanoate Ethyl 3-(3-cyclohexenyl)2,2-dichloropropanoate
Wiley ID 1252790