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#4C;(1-ALPHA,2-ALPHA,2A-BETA,4-ALPHA,5-BETA,5A-ALPHA,6A-ALPHA,6B-BETA,7-ALPHA,7A-BETA)-DECAHYDRO-1-PHENYLTHIO-5,6B-BIS-(2-PYRIDYL)-2,5,7-METHENO-1H-CYCLOBUTA-[

View entire compound with spectra: 1 NMR

#4C;(1-ALPHA,2-ALPHA,2A-BETA,4-ALPHA,5-BETA,5A-ALPHA,6A-ALPHA,6B-BETA,7-ALPHA,7A-BETA)-DECAHYDRO-1-PHENYLTHIO-5,6B-BIS-(2-PYRIDYL)-2,5,7-METHENO-1H-CYCLOBUTA-[
SpectraBase Compound ID 22GqAnRS08D
InChI InChI=1S/C27H24N4S/c1-2-8-15(9-3-1)32-25-20-22-23-21(25)24(20)31-27(23,19-11-5-7-13-29-19)17-14-16(17)26(22,30-31)18-10-4-6-12-28-18/h1-13,16-17,20-25,30H,14H2/t16-,17+,20+,21-,22+,23-,24-,25+,26+,27-/m1/s1
InChIKey WWOTXQBDZJLZPE-KUKVYYQRSA-N
Mol Weight 436.58 g/mol
Molecular Formula C27H24N4S
Exact Mass 436.172168 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7UrkBcfK5w8
Name #4C;(1-ALPHA,2-ALPHA,2A-BETA,4-ALPHA,5-BETA,5A-ALPHA,6A-ALPHA,6B-BETA,7-ALPHA,7A-BETA)-DECAHYDRO-1-PHENYLTHIO-5,6B-BIS-(2-PYRIDYL)-2,5,7-METHENO-1H-CYCLOBUTA-[
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H24N4S
InChI InChI=1S/C27H24N4S/c1-2-8-15(9-3-1)32-25-20-22-23-21(25)24(20)31-27(23,19-11-5-7-13-29-19)17-14-16(17)26(22,30-31)18-10-4-6-12-28-18/h1-13,16-17,20-25,30H,14H2/t16-,17+,20+,21-,22+,23-,24-,25+,26+,27-/m1/s1
InChIKey WWOTXQBDZJLZPE-KUKVYYQRSA-N
Literature Reference Author M.CHRISTL,H.HENNEBERGER,S.FREUND
Literature Reference Citation CHEM.BER.,121,1675(1988)
Literature Reference DOI 10.1002/cber.19881210921
Molecular Weight 436.574 g/mol
Solvent CDCl3
Source File Reference UWGB1638