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6-Phenyl-5,6-dihydrotetrazolo[1,5-d][1,4]benzothiazepine
SpectraBase Compound ID 3WQUD1XvSKW
InChI InChI=1S/C15H12N4S/c1-2-6-11(7-3-1)14-10-19-15(16-17-18-19)12-8-4-5-9-13(12)20-14/h1-9,14H,10H2
InChIKey XQCYTBAJXGPHLL-UHFFFAOYSA-N
Mol Weight 280.35 g/mol
Molecular Formula C15H12N4S
Exact Mass 280.078268 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6hLKHtnE75i
Name 6-phenyl-5,6-dihydrotetrazolo[1,5-d][1,4]benzothiazepine
Compound Number 4C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H12N4S
InChI InChI=1S/C15H12N4S/c1-2-6-11(7-3-1)14-10-19-15(16-17-18-19)12-8-4-5-9-13(12)20-14/h1-9,14H,10H2
InChIKey XQCYTBAJXGPHLL-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 280.347 g/mol
Solvent CDCl3
Source File Reference UWRU1548