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Cholesteryl benzoate(604-32-0) 13C NMR
Product NameCholesteryl benzoate
CAS604-32-0
Molecular FormulaC34H50O2
Molecular Weight490.76
InChIInChI=1/C34H50O2/c1-23(2)10-9-11-24(3)29-16-17-30-28-15-14-26-22-27(36-32(35)25-12-7-6-8-13-25)18-20-33(26,4)31(28)19-21-34(29,30)5/h6-8,12-14,23-24,27-31H,9-11,15-22H2,1-5H3/t24-,27+,28+,29-,30+,31+,33+,34-/s3
InChIKey UVZUFUGNHDDLRQ-KYXJRKCLNA-N
Smiles[C@@]12([H])CC=C3C[C@@H](OC(=O)C4C=CC=CC=4)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21[H])[C@H](C)CCCC(C)C |&1:0,6,18,20,24,26,29,31,r|
