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2A-PHENYL-4-METHYLTHIO-2-METHOXY-1,2,2A,3-TETRAHYDRO-AZETO-[1,2-A]-[1,5]-BENZODIAZEPIN-1-ONE
SpectraBase Compound ID 9KKXbpUpgnJ
InChI InChI=1S/C19H18N2O2S/c1-23-17-18(22)21-15-11-7-6-10-14(15)20-16(24-2)12-19(17,21)13-8-4-3-5-9-13/h3-11,17H,12H2,1-2H3
InChIKey MSCVEWJQCQQMGE-UHFFFAOYSA-N
Mol Weight 338.43 g/mol
Molecular Formula C19H18N2O2S
Exact Mass 338.108899 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 90CKk8CWE12
Name 2A-PHENYL-4-METHYLTHIO-2-METHOXY-1,2,2A,3-TETRAHYDRO-AZETO-[1,2-A]-[1,5]-BENZODIAZEPIN-1-ONE
Compound Number II-A
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C19H18N2O2S/c1-23-17-18(22)21-15-11-7-6-10-14(15)20-16(24-2)12-19(17,21)13-8-4-3-5-9-13/h3-11,17H,12H2,1-2H3
InChIKey MSCVEWJQCQQMGE-UHFFFAOYSA-N
Literature Reference R.MARTINEZ,P.E.HERNANDEZ,E.ANGELES J.HETCYCL.CHEM.,33,271(1996)
Solvent Chloroform-d
Technique APT, DEPT, INEPT; C/H SHIFT CORRELATION