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3-CHLOROPROPIONIC ACID, BUTYL ESTER
SpectraBase Compound ID 2swQHhRPYIC
InChI InChI=1S/C7H13ClO2/c1-2-3-6-10-7(9)4-5-8/h2-6H2,1H3
InChIKey KRZKQEQBZXWCDJ-UHFFFAOYSA-N
Mol Weight 164.63 g/mol
Molecular Formula C7H13ClO2
Exact Mass 164.060407 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6xVUKDCn9vO
Name Butyl 3-chloropropanoate
CAS Registry Number 27387-79-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H13ClO2
InChI InChI=1S/C7H13ClO2/c1-2-3-6-10-7(9)4-5-8/h2-6H2,1H3
InChIKey KRZKQEQBZXWCDJ-UHFFFAOYSA-N
Molecular Weight 164.632 g/mol
SMILES C(Cl)CC(=O)OCCCC
SPLASH splash10-0a4l-9000000000-dc3700bc23dfbddc8f0e
Source of Spectrum NP-2-1125-0
Synonyms 3-Chloropropanoic acid butyl ester 3-Chloropropionic acid, butyl ester Propanoic acid, 3-chloro-, butyl ester Butyl 3-chloranylpropanoate
Wiley ID 1100380