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Ethyl 1.beta.,3.alpha.,7..beta.-tris(dimethylethylsilyloxy)-5.beta.-cholanoate
SpectraBase Compound ID EtS3NUa0vFV
InChI InChI=1S/C38H74O5Si3/c1-14-40-35(39)21-18-27(5)30-19-20-31-36-32(22-23-37(30,31)6)38(7)28(25-33(36)42-45(10,11)16-3)24-29(41-44(8,9)15-2)26-34(38)43-46(12,13)17-4/h27-34,36H,14-26H2,1-13H3/t27-,28+,29+,30-,31+,32+,33+,34-,36+,37-,38+/m1/s1
InChIKey RACSGNRLXITMDP-INAHQHNASA-N
Mol Weight 695.3 g/mol
Molecular Formula C38H74O5Si3
Exact Mass 694.484405 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EdllrWjcKcC
Name Ethyl 1.beta.,3.alpha.,7..beta.-tris(dimethylethylsilyloxy)-5.beta.-cholanoate
Alternate Name(s) Ethyl (1beta,3alpha,5beta,7beta)-1,3,7-tris{[ethyl(dimethyl)silyl]oxy}cholan-24-oate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H74O5Si3
InChI InChI=1S/C38H74O5Si3/c1-14-40-35(39)21-18-27(5)30-19-20-31-36-32(22-23-37(30,31)6)38(7)28(25-33(36)42-45(10,11)16-3)24-29(41-44(8,9)15-2)26-34(38)43-46(12,13)17-4/h27-34,36H,14-26H2,1-13H3/t27-,28+,29+,30-,31+,32+,33+,34-,36+,37-,38+/m1/s1
InChIKey RACSGNRLXITMDP-INAHQHNASA-N
Molecular Weight 695.260 g/mol
SMILES [C@@]12([C@]([C@@]3([C@](C[C@]4([C@@]([C@]3(CC2)[H])([C@@](C[C@](C4)(O[Si](CC)(C)C)[H])(O[Si](CC)(C)C)[H])C)[H])(O[Si](CC)(C)C)[H])[H])(CC[C@@]1([C@@](CCC(=O)OCC)(C)[H])[H])[H])C
SPLASH splash10-0002-0090212000-22814f3e9faf6aaea463
Source of Spectrum JC-488-320-0
Wiley ID 1414867