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(3S)-3-(benzyl)-2-thioxo-3,4-dihydro-1H-1,4-benzodiazepin-5-one
SpectraBase Compound ID CvAgq7jRwTq
InChI InChI=1S/C16H14N2OS/c19-15-12-8-4-5-9-13(12)18-16(20)14(17-15)10-11-6-2-1-3-7-11/h1-9,14H,10H2,(H,17,19)(H,18,20)/t14-/m0/s1
InChIKey IXINSEHDQFJIGO-AWEZNQCLSA-N
Mol Weight 282.36 g/mol
Molecular Formula C16H14N2OS
Exact Mass 282.082684 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3mxFmz2OpqE
Name (3S)-3-(benzyl)-2-thioxo-3,4-dihydro-1H-1,4-benzodiazepin-5-one
Compound Number 10
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Formula C16H14N2OS
InChI InChI=1S/C16H14N2OS/c19-15-12-8-4-5-9-13(12)18-16(20)14(17-15)10-11-6-2-1-3-7-11/h1-9,14H,10H2,(H,17,19)(H,18,20)/t14-/m0/s1
InChIKey IXINSEHDQFJIGO-AWEZNQCLSA-N
Literature Reference Author H.H.SUN,C.J.BARROW,R.COOPER
Literature Reference Citation J.NAT.PROD.,58,1575(1995)
Literature Reference DOI 10.1021/np50124a015
Molecular Weight 282.360 g/mol
Solvent DMSO-D6
Source File Reference UWGE2044