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Dichloroacetic acid, 4-benzyloxyphenyl ester
SpectraBase Compound ID qIeHSgwLuJ
InChI InChI=1S/C15H12Cl2O3/c16-14(17)15(18)20-13-8-6-12(7-9-13)19-10-11-4-2-1-3-5-11/h1-9,14H,10H2
InChIKey BHDHMFXSIYFMCZ-UHFFFAOYSA-N
Mol Weight 311.16 g/mol
Molecular Formula C15H12Cl2O3
Exact Mass 310.01635 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9IQlxgsub5V
Name Dichloroacetic acid, 4-benzyloxyphenyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12Cl2O3
InChI InChI=1S/C15H12Cl2O3/c16-14(17)15(18)20-13-8-6-12(7-9-13)19-10-11-4-2-1-3-5-11/h1-9,14H,10H2
InChIKey BHDHMFXSIYFMCZ-UHFFFAOYSA-N
Molecular Weight 311.164 g/mol
SMILES c1ccc(cc1)COc1ccc(OC(C(Cl)Cl)=O)cc1
SPLASH splash10-0006-9000000000-1d3d2e17a0843026c358
Source of Spectrum NP-10-6548-0
Synonyms 2,2-Dichloroacetic acid (4-phenylmethoxyphenyl) ester (4-phenylmethoxyphenyl) 2,2-dichloroacetate (4-benzyloxyphenyl) 2,2-dichloroacetate (4-phenylmethoxyphenyl) 2,2-bis(chloranyl)ethanoate
Wiley ID 1109064