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Hexanoic acid, 6-chloro-, chloromethyl ester
SpectraBase Compound ID JBpTwWNagtN
InChI InChI=1S/C7H12Cl2O2/c8-5-3-1-2-4-7(10)11-6-9/h1-6H2
InChIKey NFZSDYANLAMKQW-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 3rx8xfvfiMm
Name Hexanoic acid, 6-chloro-, chloromethyl ester
Alternate Name(s) 6-Chlorohexanoic acid chloromethyl ester Chloromethyl 6-chloranylhexanoate Chloromethyl 6-chlorohexanoate
CAS Registry Number 80418-57-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12Cl2O2
InChI InChI=1S/C7H12Cl2O2/c8-5-3-1-2-4-7(10)11-6-9/h1-6H2
InChIKey NFZSDYANLAMKQW-UHFFFAOYSA-N
Molecular Weight 199.077 g/mol
SMILES C(CCC(OCCl)=O)CCCl
SPLASH splash10-0a4l-9300000000-152320bd2fb6fa9fc42f
Source of Spectrum O-19-38-20
Wiley ID 1194871