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Hexanoic acid, 3-chloro-, chloromethyl ester
SpectraBase Compound ID HUsxZirEFh4
InChI InChI=1S/C7H12Cl2O2/c1-2-3-6(9)4-7(10)11-5-8/h6H,2-5H2,1H3
InChIKey FWVZTAJOBMVDDT-UHFFFAOYSA-N
Mol Weight 199.08 g/mol
Molecular Formula C7H12Cl2O2
Exact Mass 198.021435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4wc0HGjr1DN
Name Hexanoic acid, 3-chloro-, chloromethyl ester
CAS Registry Number 80418-54-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12Cl2O2
InChI InChI=1S/C7H12Cl2O2/c1-2-3-6(9)4-7(10)11-5-8/h6H,2-5H2,1H3
InChIKey FWVZTAJOBMVDDT-UHFFFAOYSA-N
Molecular Weight 199.077 g/mol
SMILES C(Cl)OC(CC(CCC)Cl)=O
SPLASH splash10-014l-9100000000-59c95ffc675688109405
Source of Spectrum O-19-38-17
Synonyms 3-Chlorohexanoic acid chloromethyl ester Chloromethyl 3-chloranylhexanoate Chloromethyl 3-chlorohexanoate
Wiley ID 1194868