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1-(2-Benzofuranyl)-2-(dichloroacetamido)propane-1,3-diol
SpectraBase Compound ID CrjZqxfC7mv
InChI InChI=1S/C13H13Cl2NO4/c14-12(15)13(19)16-8(6-17)11(18)10-5-7-3-1-2-4-9(7)20-10/h1-5,8,11-12,17-18H,6H2,(H,16,19)
InChIKey FXNSMHZTLITRNN-UHFFFAOYSA-N
Mol Weight 318.16 g/mol
Molecular Formula C13H13Cl2NO4
Exact Mass 317.022163 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5FabemOR6of
Name 1-(2-Benzofuranyl)-2-(dichloroacetamido)propane-1,3-diol
CAS Registry Number 74599-88-5
Comments Less than 3 mono-isotopic peaks
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Formula C13H13Cl2NO4
InChI InChI=1S/C13H13Cl2NO4/c14-12(15)13(19)16-8(6-17)11(18)10-5-7-3-1-2-4-9(7)20-10/h1-5,8,11-12,17-18H,6H2,(H,16,19)
InChIKey FXNSMHZTLITRNN-UHFFFAOYSA-N
Molecular Weight 318.156 g/mol
SMILES N(C(C(Cl)Cl)=O)C(CO)C(c1oc2ccccc2c1)O
SPLASH splash10-0002-0900000000-3fc0cdb73c71ba239d41
Source of Spectrum Y-17-614-0
Synonyms 2-Dichloroacetamido-1-(2-benzofuranyl)propane-1,3-diol Acetamide, N-(2-(2-benzofuranyl)-2-hydroxy-1-(hydroxymethyl)ethyl)-2,2-dichloro-, (R*,S*)-(+-)- BFDCA-POH2 N-[1-(1-benzofuran-2-yl)-1,3-bis(oxidanyl)propan-2-yl]-2,2-bis(chloranyl)ethanamide N-[1-(1-benzofuran-2-yl)-1,3-dihydroxypropan-2-yl]-2,2-dichloroacetamide N-[1-(2-benzofuranyl)-1,3-dihydroxypropan-2-yl]-2,2-dichloroacetamide N-[2-(benzofuran-2-yl)-2-hydroxy-1-(hydroxymethyl)ethyl]-2,2-dichloro-acetamide N-[2-(benzofuran-2-yl)-2-hydroxy-1-methylol-ethyl]-2,2-dichloro-acetamide
Wiley ID 1317507