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2-PHENYL-4-(2'-HYDROXYPHENYL)-4,5-DIHYDRO-1,5-BENZOTHIAZEPINE
SpectraBase Compound ID JEhDcrGL3oC
InChI InChI=1S/C21H17NOS/c23-19-12-6-4-10-16(19)18-14-21(15-8-2-1-3-9-15)24-20-13-7-5-11-17(20)22-18/h1-14,18,22-23H
InChIKey PPNICXGDYSIYQZ-UHFFFAOYSA-N
Mol Weight 331.43 g/mol
Molecular Formula C21H17NOS
Exact Mass 331.103085 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8dV0SXctqg
Name 2-PHENYL-4-(2'-HYDROXYPHENYL)-4,5-DIHYDRO-1,5-BENZOTHIAZEPINE
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H17NOS
InChI InChI=1S/C21H17NOS/c23-19-12-6-4-10-16(19)18-14-21(15-8-2-1-3-9-15)24-20-13-7-5-11-17(20)22-18/h1-14,18,22-23H
InChIKey PPNICXGDYSIYQZ-UHFFFAOYSA-N
Literature Reference Author R.AHMAD,M.ZIA-UL-HAQ,S.HAMEED,H.AKHTAR,H.DUDDECK
Literature Reference Citation MH.CHEM.,131,393(2000)
Literature Reference DOI 10.1007/s007060050320
Molecular Weight 331.432 g/mol
Solvent CDCl3
Source File Reference UWRU1281