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o-[2,3-dihydro-2-(4-pyridyl)-1,5-benzothiazepin-4-yl]phenol

View entire compound with spectra: 3 NMR, and 1 FTIR

o-[2,3-dihydro-2-(4-pyridyl)-1,5-benzothiazepin-4-yl]phenol
SpectraBase Compound ID 52v8b9MpvGy
InChI InChI=1S/C20H16N2OS/c23-18-7-3-1-5-15(18)17-13-20(14-9-11-21-12-10-14)24-19-8-4-2-6-16(19)22-17/h1-12,20,23H,13H2
InChIKey XJKXAWGPSIVQII-UHFFFAOYSA-N
Mol Weight 332.42 g/mol
Molecular Formula C20H16N2OS
Exact Mass 332.098334 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Lv29imQloFQ
Name o-[2,3-DIHYDRO-2-(4-PYRIDYL)-1,5-BENZOTHIAZEPIN-4-YL]PHENOL
Source of Sample K. Hideg, University Medical School, Pecs, Hungary
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H16N2OS
InChI InChI=1S/C20H16N2OS/c23-18-7-3-1-5-15(18)17-13-20(14-9-11-21-12-10-14)24-19-8-4-2-6-16(19)22-17/h1-12,20,23H,13H2
InChIKey XJKXAWGPSIVQII-UHFFFAOYSA-N
Melting Point 140-141C
Molecular Weight 332.43
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms PHENOL, O-/2,3-DIHYDRO- 2-/4-PYRIDYL/-1,5-BENZOTHIAZEPIN- 4-YL/-,