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6-METHYL-3-PHENYLPYRIDO-[3,2-F]-[1,4]-THIAZEPINE-5,8-DIBENZOATE
SpectraBase Compound ID KMM6S0XwixN
InChI InChI=1S/C29H20N2O4S/c1-19-17-24(34-28(32)21-13-7-3-8-14-21)31-27-25(19)26(35-29(33)22-15-9-4-10-16-22)30-23(18-36-27)20-11-5-2-6-12-20/h2-18H,1H3
InChIKey ZEVJTOQCLZIXNO-UHFFFAOYSA-N
Mol Weight 492.55 g/mol
Molecular Formula C29H20N2O4S
Exact Mass 492.114378 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 21EbSMid1O
Name 6-METHYL-3-PHENYLPYRIDO-[3,2-F]-[1,4]-THIAZEPINE-5,8-DIBENZOATE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H20N2O4S
InChI InChI=1S/C29H20N2O4S/c1-19-17-24(34-28(32)21-13-7-3-8-14-21)31-27-25(19)26(35-29(33)22-15-9-4-10-16-22)30-23(18-36-27)20-11-5-2-6-12-20/h2-18H,1H3
InChIKey ZEVJTOQCLZIXNO-UHFFFAOYSA-N
Literature Reference Author R.M.FATY,M.M.YOUSSEF,A.M.S.YOUSSEF
Literature Reference Citation MOLECULES,16,4549(2011)
Literature Reference DOI 10.3390/molecules16064549
Molecular Weight 492.549 g/mol
Sample ID 215
Solvent DMSO-D6