| SpectraBase Compound ID | Ap0bxnDpO5v |
|---|---|
| InChI | InChI=1S/C28H48O/c1-18(2)8-7-9-19(3)22-12-13-24-21-10-11-23-20(4)26(29)15-17-28(23,6)25(21)14-16-27(22,24)5/h18-19,21-26,29H,4,7-17H2,1-3,5-6H3/t19-,21+,22-,23?,24+,25+,26+,27-,28+/m1/s1 |
| InChIKey | VZIGRTXYYCCTRR-WWTRGHTASA-N |
| Mol Weight | 400.7 g/mol |
| Molecular Formula | C28H48O |
| Exact Mass | 400.370516 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8kP5MNB6zxo |
|---|---|
| Name | 4-Methylenecholestan-3.beta.-ol |
| Alternate Name(s) | (3beta)-4-methylenecholestan-3-ol |
| CAS Registry Number | 76758-17-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H48O |
| InChI | InChI=1S/C28H48O/c1-18(2)8-7-9-19(3)22-12-13-24-21-10-11-23-20(4)26(29)15-17-28(23,6)25(21)14-16-27(22,24)5/h18-19,21-26,29H,4,7-17H2,1-3,5-6H3/t19-,21+,22-,23?,24+,25+,26+,27-,28+/m1/s1 |
| InChIKey | VZIGRTXYYCCTRR-WWTRGHTASA-N |
| Molecular Weight | 400.691 g/mol |
| SMILES | O[C@]1(CC[C@]2(C(C1=C)CC[C@]1([C@@]3(CC[C@@]([C@]3(CC[C@]21[H])C)([C@@](CCCC(C)C)(C)[H])[H])[H])[H])C)[H] |
| SPLASH | splash10-0uea-6029700000-1685eb9c12eaf94913ac |
| Source of Spectrum | J-46-1839-0 |
| Wiley ID | 1369809 |