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3,4-dichlorobutyric acid, methyl ester
SpectraBase Compound ID 3HALUhsQsD5
InChI InChI=1S/C5H8Cl2O2/c1-9-5(8)2-4(7)3-6/h4H,2-3H2,1H3
InChIKey DVXYQNCRDDPGKM-UHFFFAOYSA-N
Mol Weight 171.02 g/mol
Molecular Formula C5H8Cl2O2
Exact Mass 169.990135 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3CgJZHYU7ki
Name Methyl 3,4-dichlorobutanoate
Alternate Name(s) Butanoic acid, 3,4-dichloro-, methyl ester 3,4-Dichlorobutanoic acid methyl ester Methyl 3,4-bis(chloranyl)butanoate
CAS Registry Number 819-93-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H8Cl2O2
InChI InChI=1S/C5H8Cl2O2/c1-9-5(8)2-4(7)3-6/h4H,2-3H2,1H3
InChIKey DVXYQNCRDDPGKM-UHFFFAOYSA-N
Molecular Weight 171.023 g/mol
SMILES C(C(CC(OC)=O)Cl)Cl
SPLASH splash10-0kbv-9400000000-cbd5c280fda01b1aeddd
Source of Spectrum NP-2-4296-0
Wiley ID 1100968