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Allophanic acid, N-(p-chlorobenzoyl)-, phenyl ester
SpectraBase Compound ID CQ29IwuNzd9
InChI InChI=1S/C15H11ClN2O4/c16-11-8-6-10(7-9-11)13(19)17-14(20)18-15(21)22-12-4-2-1-3-5-12/h1-9H,(H2,17,18,19,20,21)
InChIKey VQMVLXFVOSTSPJ-UHFFFAOYSA-N
Mol Weight 318.72 g/mol
Molecular Formula C15H11ClN2O4
Exact Mass 318.040735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6VKEmVpRHa8
Name Allophanic acid, N-(p-chlorobenzoyl)-, phenyl ester
Alternate Name(s) N-[(4-chlorobenzoyl)carbamoyl]carbamic acid phenyl ester N-[[[(4-chlorophenyl)-oxomethyl]amino]-oxomethyl]carbamic acid phenyl ester phenyl N-[(4-chlorobenzoyl)carbamoyl]carbamate phenyl N-[(4-chlorophenyl)carbonylcarbamoyl]carbamate
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Formula C15H11ClN2O4
InChI InChI=1S/C15H11ClN2O4/c16-11-8-6-10(7-9-11)13(19)17-14(20)18-15(21)22-12-4-2-1-3-5-12/h1-9H,(H2,17,18,19,20,21)
InChIKey VQMVLXFVOSTSPJ-UHFFFAOYSA-N
Molecular Weight 318.716 g/mol
SMILES N(C(Oc1ccccc1)=O)C(=O)NC(=O)c1ccc(cc1)Cl
SPLASH splash10-000f-9500000000-7ca0162fbcb9f3526947
Wiley ID 1494968