For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Butanoic acid, 3-chloro-, chloromethyl ester
SpectraBase Compound ID lrhddlpbDy
InChI InChI=1S/C5H8Cl2O2/c1-4(7)2-5(8)9-3-6/h4H,2-3H2,1H3
InChIKey GWYHWJBUTPNSIJ-UHFFFAOYSA-N
Mol Weight 171.02 g/mol
Molecular Formula C5H8Cl2O2
Exact Mass 169.990135 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 7zixD77CF6o
Name Butanoic acid, 3-chloro-, chloromethyl ester
Alternate Name(s) 3-Chlorobutanoic acid chloromethyl ester 3-Chlorobutyric acid chloromethyl ester Chloromethyl 3-chloranylbutanoate Chloromethyl 3-chlorobutanoate
CAS Registry Number 80418-48-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H8Cl2O2
InChI InChI=1S/C5H8Cl2O2/c1-4(7)2-5(8)9-3-6/h4H,2-3H2,1H3
InChIKey GWYHWJBUTPNSIJ-UHFFFAOYSA-N
Molecular Weight 171.023 g/mol
SMILES CC(CC(OCCl)=O)Cl
SPLASH splash10-052o-9400000000-4845bf929a2b5de8c61c
Source of Spectrum O-19-38-8
Wiley ID 1166091