| SpectraBase Compound ID | 1dJtnJA45AV |
|---|---|
| InChI | InChI=1S/C28H50/c1-19(2)9-7-10-20(3)24-14-15-25-22-12-13-23-21(4)11-8-17-27(23,5)26(22)16-18-28(24,25)6/h19-26H,7-18H2,1-6H3/t20-,21?,22+,23?,24?,25?,26?,27+,28-/m1/s1 |
| InChIKey | AJHKOHJONNVXCK-NQRLITKISA-N |
| Mol Weight | 386.7 g/mol |
| Molecular Formula | C28H50 |
| Exact Mass | 386.391252 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4r6lTgCejQ |
|---|---|
| Name | 4-Methyl-20R-cholestane |
| Alternate Name(s) | 4-Methylcholestane |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H50 |
| InChI | InChI=1S/C28H50/c1-19(2)9-7-10-20(3)24-14-15-25-22-12-13-23-21(4)11-8-17-27(23,5)26(22)16-18-28(24,25)6/h19-26H,7-18H2,1-6H3/t20-,21?,22+,23?,24?,25?,26?,27+,28-/m1/s1 |
| InChIKey | AJHKOHJONNVXCK-NQRLITKISA-N |
| Molecular Weight | 386.708 g/mol |
| SMILES | [C@@]12(C([C@@]3(CCC4[C@@](C3CC2)(CCCC4C)C)[H])CCC1[C@@](CCCC(C)C)(C)[H])C |
| SPLASH | splash10-00dl-0912000000-cb40a2b1f66cfc3ede86 |
| Source of Spectrum | WX-1981-6-0 |
| Wiley ID | 1363230 |