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(3aSR,8bRS)-2,3,3a,4,6,8b-Hexahydro-1,8-dimethyl-6-phenyl-2-phenylacetyl-1H-thiopyrano[2,3-c:4,5-c']dipyrazole
SpectraBase Compound ID F0MolYbwxH9
InChI InChI=1S/C23H24N4OS/c1-16-21-22-18(15-29-23(21)27(24-16)19-11-7-4-8-12-19)14-26(25(22)2)20(28)13-17-9-5-3-6-10-17/h3-12,18,22H,13-15H2,1-2H3/t18-,22-/m1/s1
InChIKey PXMYUEFKVDYYOM-XMSQKQJNSA-N
Mol Weight 404.53 g/mol
Molecular Formula C23H24N4OS
Exact Mass 404.167083 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8V5F8nvdByC
Name (3ASR,8BRS)-2,3,3A,4,6,8B-HEXAHYDRO-1,8-DIMETHYL-6-PHENYL-2-PHENYLACETYL-1H-THIOPYRANO-[2,3-C:4,5-C']-DIPYRAZOLE
Compound Number 21
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C23H24N4OS/c1-16-21-22-18(15-29-23(21)27(24-16)19-11-7-4-8-12-19)14-26(25(22)2)20(28)13-17-9-5-3-6-10-17/h3-12,18,22H,13-15H2,1-2H3/t18-,22-/m1/s1
InChIKey PXMYUEFKVDYYOM-XMSQKQJNSA-N
Literature Reference G.LABBE,S.EMMERS,W.DEHAEN,L.K.DYALL J.CHEM.SOC.PERKIN-1,2553(1994)
Solvent Chloroform-d