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Chola-5,23-dien-1-ol, 24,24-diphenyl-
SpectraBase Compound ID 69pzGnKDI6F
InChI InChI=1S/C36H46O/c1-25(17-19-29(26-11-6-4-7-12-26)27-13-8-5-9-14-27)31-21-22-32-30-20-18-28-15-10-16-34(37)36(28,3)33(30)23-24-35(31,32)2/h4-9,11-14,18-19,25,30-34,37H,10,15-17,20-24H2,1-3H3
InChIKey YTKFJFURRMATBD-UHFFFAOYSA-N
Mol Weight 494.8 g/mol
Molecular Formula C36H46O
Exact Mass 494.354866 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DYUO3AE24GN
Name Chola-5,23-dien-1-ol, 24,24-diphenyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 494.354866100 u
Formula C36H46O
InChI InChI=1S/C36H46O/c1-25(17-19-29(26-11-6-4-7-12-26)27-13-8-5-9-14-27)31-21-22-32-30-20-18-28-15-10-16-34(37)36(28,3)33(30)23-24-35(31,32)2/h4-9,11-14,18-19,25,30-34,37H,10,15-17,20-24H2,1-3H3
InChIKey YTKFJFURRMATBD-UHFFFAOYSA-N
Molecular Weight 494.763 g/mol
SMILES OC1C2(C3CCC4(C(C3CC=C2CCC1)CCC4C(CC=C(C=1C=CC=CC1)C1=CC=CC=C1)C)C)C