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6-METHYL-7-PARA-TOLUOYL-2,3,4,5A,6,11-B-HEXAHYDRO-[1.4]-OXATHIEPINO-[2.3-C]-QUINOLINE
SpectraBase Compound ID 5P8HcekF1Xu
InChI InChI=1S/C21H23NO2S/c1-14-8-10-16(11-9-14)21(23)22-15(2)19-20(25-13-5-12-24-19)17-6-3-4-7-18(17)22/h3-4,6-11,15,19-20H,5,12-13H2,1-2H3
InChIKey FPFZJGGBYFUHFI-UHFFFAOYSA-N
Mol Weight 353.48 g/mol
Molecular Formula C21H23NO2S
Exact Mass 353.14495 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9tCtfiwnLIZ
Name 6-METHYL-7-PARA-TOLUOYL-2,3,4,5A,6,11-B-HEXAHYDRO-[1.4]-OXATHIEPINO-[2.3-C]-QUINOLINE
Compound Number 2B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H23NO2S
InChI InChI=1S/C21H23NO2S/c1-14-8-10-16(11-9-14)21(23)22-15(2)19-20(25-13-5-12-24-19)17-6-3-4-7-18(17)22/h3-4,6-11,15,19-20H,5,12-13H2,1-2H3
InChIKey FPFZJGGBYFUHFI-UHFFFAOYSA-N
Literature Reference Author R.HIESSBOECK,M.KRATZEL
Literature Reference Citation J.HETCYCL.CHEM.,36,1295(1999)
Literature Reference DOI 10.1002/jhet.5570360530
Molecular Weight 353.479 g/mol
Solvent CDCl3
Source File Reference UWMZ22222