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7-Chloro-4-(4-methoxyphenyl)-1H-1,5-benzodiazepin-2(3H)-one
SpectraBase Compound ID JsToLawbIh5
InChI InChI=1S/C16H13ClN2O2/c1-21-12-5-2-10(3-6-12)14-9-16(20)19-13-7-4-11(17)8-15(13)18-14/h2-8H,9H2,1H3,(H,19,20)
InChIKey LVCXSCOBUYFIBF-UHFFFAOYSA-N
Mol Weight 300.75 g/mol
Molecular Formula C16H13ClN2O2
Exact Mass 300.066555 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JnF9jHo1ZfQ
Name 7-Chloro-4-(4-methoxyphenyl)-1H-1,5-benzodiazepin-2(3H)-one
Alternate Name(s) 7-chloro-4-(4-methoxyphenyl)-1,3-dihydro-2H-1,5-benzodiazepin-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C16H13ClN2O2
InChI InChI=1S/C16H13ClN2O2/c1-21-12-5-2-10(3-6-12)14-9-16(20)19-13-7-4-11(17)8-15(13)18-14/h2-8H,9H2,1H3,(H,19,20)
InChIKey LVCXSCOBUYFIBF-UHFFFAOYSA-N
Molecular Weight 300.745 g/mol
SMILES N1c2c(N=C(CC1=O)c1ccc(cc1)OC)cc(cc2)Cl
SPLASH splash10-0pb9-0096000000-556bd58928a730f1af08
Source of Spectrum SO-0-447-3
Wiley ID 1543207