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3.alpha.,12.alpha.,24-tris(Acetoxy)-5.beta.-cholane
SpectraBase Compound ID Jzos54olGjC
InChI InChI=1S/C30H48O6/c1-18(8-7-15-34-19(2)31)25-11-12-26-24-10-9-22-16-23(35-20(3)32)13-14-29(22,5)27(24)17-28(30(25,26)6)36-21(4)33/h18,22-28H,7-17H2,1-6H3/t18-,22-,23-,24+,25-,26+,27+,28+,29+,30-/m1/s1
InChIKey UDKZZKBWIGSKJH-KQWFBRKLSA-N
Mol Weight 504.7 g/mol
Molecular Formula C30H48O6
Exact Mass 504.345089 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EoxbQoH6iKY
Name 3.alpha.,12.alpha.,24-tris(Acetoxy)-5.beta.-cholane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H48O6
InChI InChI=1S/C30H48O6/c1-18(8-7-15-34-19(2)31)25-11-12-26-24-10-9-22-16-23(35-20(3)32)13-14-29(22,5)27(24)17-28(30(25,26)6)36-21(4)33/h18,22-28H,7-17H2,1-6H3/t18-,22-,23-,24+,25-,26+,27+,28+,29+,30-/m1/s1
InChIKey UDKZZKBWIGSKJH-KQWFBRKLSA-N
Molecular Weight 504.708 g/mol
SMILES [C@@]12([C@]([C@@]3(CC[C@]4([C@@]([C@]3(C[C@@]2(OC(=O)C)[H])[H])(CC[C@@](OC(=O)C)(C4)[H])C)[H])[H])(CC[C@@]1([C@@](CCCOC(=O)C)(C)[H])[H])[H])C
SPLASH splash10-0a59-0095000000-818fcefb8ffb4b9add81
Source of Spectrum C-121-6650-13
Wiley ID 1700247