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Heptanoic acid, 2-chloro-, chloromethyl ester
SpectraBase Compound ID CipBIDYJmPM
InChI InChI=1S/C8H14Cl2O2/c1-2-3-4-5-7(10)8(11)12-6-9/h7H,2-6H2,1H3
InChIKey OEONOJHNBIZMIO-UHFFFAOYSA-N
Mol Weight 213.1 g/mol
Molecular Formula C8H14Cl2O2
Exact Mass 212.037085 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BhxdYfVCZFi
Name Heptanoic acid, 2-chloro-, chloromethyl ester
Alternate Name(s) 2-Chloroenanthic acid chloromethyl ester 2-Chloroheptanoic acid chloromethyl ester Chloromethyl 2-chloranylheptanoate Chloromethyl 2-chloroheptanoate
CAS Registry Number 80418-58-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14Cl2O2
InChI InChI=1S/C8H14Cl2O2/c1-2-3-4-5-7(10)8(11)12-6-9/h7H,2-6H2,1H3
InChIKey OEONOJHNBIZMIO-UHFFFAOYSA-N
Molecular Weight 213.104 g/mol
SMILES CCCCCC(C(OCCl)=O)Cl
SPLASH splash10-0a4i-5900000000-b7061a7b57a8be0553a5
Source of Spectrum O-19-39-22
Wiley ID 1210830