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LGYGVLUGNCZQGP-UHFFFAOYSA-N
SpectraBase Compound ID CE0toJWfvmG
InChI InChI=1S/C16H15BrN2O3S/c1-23(21,22)19-14-5-3-2-4-13(14)18-16(20)10-15(19)11-6-8-12(17)9-7-11/h2-9,15H,10H2,1H3,(H,18,20)
InChIKey LGYGVLUGNCZQGP-UHFFFAOYSA-N
Mol Weight 395.27 g/mol
Molecular Formula C16H15BrN2O3S
Exact Mass 393.998677 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9dHq0ZVGBCV
Name 4-(4-bromophenyl)-5-mesyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one
Alternate Name(s) 4-(4-bromophenyl)-5-methylsulfonyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one
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Formula C16H15BrN2O3S
InChI InChI=1S/C16H15BrN2O3S/c1-23(21,22)19-14-5-3-2-4-13(14)18-16(20)10-15(19)11-6-8-12(17)9-7-11/h2-9,15H,10H2,1H3,(H,18,20)
InChIKey LGYGVLUGNCZQGP-UHFFFAOYSA-N
Molecular Weight 395.271 g/mol
SMILES N1C(CC(N(c2c1cccc2)S(=O)(=O)C)c1ccc(cc1)Br)=O
SPLASH splash10-0axs-0096000000-b5629b21fbe678fa2dc7
Source of Spectrum KC-0-3481-3
Wiley ID 829685