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5,6,6a,7-tetrahydro-7-p-tolylbenzo[b]naphtho[1,2-e][1,4]thiazepine

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

5,6,6a,7-tetrahydro-7-p-tolylbenzo[b]naphtho[1,2-e][1,4]thiazepine
SpectraBase Compound ID 1rl8bZF3ZAS
InChI InChI=1S/C24H21NS/c1-16-10-12-18(13-11-16)24-20-15-14-17-6-2-3-7-19(17)23(20)25-21-8-4-5-9-22(21)26-24/h2-13,20,24H,14-15H2,1H3
InChIKey QOHIIMCHEJRGSH-UHFFFAOYSA-N
Mol Weight 355.5 g/mol
Molecular Formula C24H21NS
Exact Mass 355.139471 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LlXti7iBEuc
Name 5,6,6a,7-TETRAHYDRO-7-p-TOLYLBENZO[b]NAPHTHO[1,2-e][1,4]THIAZEPINE
Source of Sample K. Hideg, University Medical School, Pecs, Hungary
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H21NS
InChI InChI=1S/C24H21NS/c1-16-10-12-18(13-11-16)24-20-15-14-17-6-2-3-7-19(17)23(20)25-21-8-4-5-9-22(21)26-24/h2-13,20,24H,14-15H2,1H3
InChIKey QOHIIMCHEJRGSH-UHFFFAOYSA-N
Melting Point 184-186C
Molecular Weight 355.51
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms BENZO/B/NAPHTHO/1,2-E//1,4/THIAZEPINE, 5,6,6A,7-TETRAHYDRO-7-P- TOLYL-,