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Clorazepate K2 (dep)

View entire compound with spectra: 2 MS (GC)

Clorazepate K2 (dep)
SpectraBase Compound ID 7ONw7cGCMNS
InChI InChI=1S/C16H11ClN2O3/c17-10-6-7-12-11(8-10)13(9-4-2-1-3-5-9)19-14(16(21)22)15(20)18-12/h1-8,14H,(H,18,20)(H,21,22)
InChIKey XDDJGVMJFWAHJX-UHFFFAOYSA-N
Mol Weight 314.73 g/mol
Molecular Formula C16H11ClN2O3
Exact Mass 314.04582 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EhWC5PlmWr7
Name 7-Chloranyl-2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepine-3-carboxylic acid
Alternate Name(s) 7-Chloro-2-keto-5-phenyl-1,3-dihydro-1,4-benzodiazepine-3-carboxylic acid 7-Chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepine-3-carboxylic acid 7-Chloro-2-oxo-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepine-3-carboxylic acid
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Formula C16H11ClN2O3
InChI InChI=1S/C16H11ClN2O3/c17-10-6-7-12-11(8-10)13(9-4-2-1-3-5-9)19-14(16(21)22)15(20)18-12/h1-8,14H,(H,18,20)(H,21,22)
InChIKey XDDJGVMJFWAHJX-UHFFFAOYSA-N
Molecular Weight 314.728 g/mol
SMILES N1C(C(C(O)=O)N=C(c2c1ccc(c2)Cl)c1ccccc1)=O
SPLASH splash10-0006-3390000000-c5558f1972f3183e7bc5
Wiley ID 1471504