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3,6-DIPHENYL-2,5-DIPROPYL-1H-1,4-DIAZEPINE-7(6H)-THIONE;MAJOR-ISOMER;COPMOUND-#8C
SpectraBase Compound ID 1dLDnr8LDkj
InChI InChI=1S/C23H26N2S/c1-3-11-19-21(17-13-7-5-8-14-17)24-20(12-4-2)22(25-23(19)26)18-15-9-6-10-16-18/h5-10,13-16,19H,3-4,11-12H2,1-2H3,(H,25,26)
InChIKey COFUMEPGLDWWHP-UHFFFAOYSA-N
Mol Weight 362.54 g/mol
Molecular Formula C23H26N2S
Exact Mass 362.18167 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2fZlSJUENOh
Name 3,6-DIPHENYL-2,5-DIPROPYL-1H-1,4-DIAZEPINE-7(6H)-THIONE;MAJOR-ISOMER;COPMOUND-#8C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H26N2S
InChI InChI=1S/C23H26N2S/c1-3-11-19-21(17-13-7-5-8-14-17)24-20(12-4-2)22(25-23(19)26)18-15-9-6-10-16-18/h5-10,13-16,19H,3-4,11-12H2,1-2H3,(H,25,26)
InChIKey COFUMEPGLDWWHP-UHFFFAOYSA-N
Literature Reference Author J.BARLUENGA,R.P.CARLON,J.GONZALEZ,J.JOGLAR,F.L.ORTIZ,S.FUSTE RO
Literature Reference Citation BULL.SOC.CHIM.FR.,129,566(1992)
Molecular Weight 362.533 g/mol
Solvent DMSO-D6
Source File Reference UWMR291