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2-Chloro-1-(chloromethyl)ethyl 4-(2,4-dichloroanilino)-4-oxobutanoate

View entire compound with spectra: 2 NMR

2-Chloro-1-(chloromethyl)ethyl 4-(2,4-dichloroanilino)-4-oxobutanoate
SpectraBase Compound ID 17WkDdLIpf
InChI InChI=1S/C13H13Cl4NO3/c14-6-9(7-15)21-13(20)4-3-12(19)18-11-2-1-8(16)5-10(11)17/h1-2,5,9H,3-4,6-7H2,(H,18,19)
InChIKey NYSQGERPCZEIOZ-UHFFFAOYSA-N
Mol Weight 373.1 g/mol
Molecular Formula C13H13Cl4NO3
Exact Mass 370.964954 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IlndWPadVpy
Name 2-Chloro-1-(chloromethyl)ethyl 4-(2,4-dichloroanilino)-4-oxobutanoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 370.964954080 u
Formula C13H13Cl4NO3
InChI InChI=1S/C13H13Cl4NO3/c14-6-9(7-15)21-13(20)4-3-12(19)18-11-2-1-8(16)5-10(11)17/h1-2,5,9H,3-4,6-7H2,(H,18,19)
InChIKey NYSQGERPCZEIOZ-UHFFFAOYSA-N
Molecular Weight 373.063 g/mol
SMILES N(C1=C(C=C(C=C1)Cl)Cl)C(=O)CCC(OC(CCl)CCl)=O