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4'-Chlorodiazepam
SpectraBase Compound ID HZAkWsXZNkH
InChI InChI=1S/C16H12Cl2N2O/c1-20-14-7-6-12(18)8-13(14)16(19-9-15(20)21)10-2-4-11(17)5-3-10/h2-8H,9H2,1H3
InChIKey PUMYFTJOWAJIKF-UHFFFAOYSA-N
Mol Weight 319.19 g/mol
Molecular Formula C16H12Cl2N2O
Exact Mass 318.032668 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0d9vyuh1ZQ
Name 4-Chlorodiazepam
Alternate Name(s) 7-Chloro-5-(4-chlorophenyl)-1-methyl-3H-1,4-benzodiazepin-2-one 4'-Chlorodiazepam Chlorodiazepam RO5-4864 7-Chloro-5-(4-chlorophenyl)-1-methyl-1,3-dihydro-2H-benzo[e][1,4]diazepin-2-one
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Formula C16H12Cl2N2O
InChI InChI=1S/C16H12Cl2N2O/c1-20-14-7-6-12(18)8-13(14)16(19-9-15(20)21)10-2-4-11(17)5-3-10/h2-8H,9H2,1H3
InChIKey PUMYFTJOWAJIKF-UHFFFAOYSA-N
Molecular Weight 319.191 g/mol
SMILES c12N(C(CN=C(c2cc(Cl)cc1)c1ccc(cc1)Cl)=O)C
SPLASH splash10-00kf-3793000000-42840fd2506746bce203
Source of Spectrum SWG-33-4764-0
Wiley ID 1811357