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2-Phenyl-2,3,4,5-tetrahydro-1,4-benzothiazepin-5-on

View entire compound with spectra: 4 NMR, and 2 MS (GC)

2-Phenyl-2,3,4,5-tetrahydro-1,4-benzothiazepin-5-on
SpectraBase Compound ID HagKr9d7tr1
InChI InChI=1S/C15H13NOS/c17-15-12-8-4-5-9-13(12)18-14(10-16-15)11-6-2-1-3-7-11/h1-9,14H,10H2,(H,16,17)
InChIKey AVCFUYURQJNPDN-UHFFFAOYSA-N
Mol Weight 255.33 g/mol
Molecular Formula C15H13NOS
Exact Mass 255.071785 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BNrO2K1twA6
Name AVCFUYURQJNPDN-UHFFFAOYSA-N
Compound Number 2C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H13NOS
InChI InChI=1S/C15H13NOS/c17-15-12-8-4-5-9-13(12)18-14(10-16-15)11-6-2-1-3-7-11/h1-9,14H,10H2,(H,16,17)
InChIKey AVCFUYURQJNPDN-UHFFFAOYSA-N
Literature Reference Author M.J.MPHAHLELE,P.T.KAYE
Literature Reference Citation MAGN.RES.CHEM.,36,69(1998)
Literature Reference DOI 10.1002/(sici)1097-458x(199801)36:1<69::aid-omr219>3.0.co;2-s
Molecular Weight 255.334 g/mol
Solvent CDCl3
Source File Reference UWRU1542