| SpectraBase Compound ID | KTitH5XkHow |
|---|---|
| InChI | InChI=1S/C29H48O/c1-18(2)21(5)19(3)16-20(4)25-10-11-26-24-9-8-22-17-23(30)12-14-28(22,6)27(24)13-15-29(25,26)7/h8,16,18,20-21,23-27,30H,9-15,17H2,1-7H3/b19-16+/t20-,21-,23?,24+,25-,26+,27+,28+,29-/m1/s1 |
| InChIKey | SXOOOXJHQQTJJY-RGFUMWOKSA-N |
| Mol Weight | 412.7 g/mol |
| Molecular Formula | C29H48O |
| Exact Mass | 412.370516 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FNdYAyec3Zk |
|---|---|
| Name | 23,24(R)-dimethylcholesta 5,22(E)-diene-3-ol |
| Alternate Name(s) | (22E)-23-methylergosta-5,22-dien-3-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H48O |
| InChI | InChI=1S/C29H48O/c1-18(2)21(5)19(3)16-20(4)25-10-11-26-24-9-8-22-17-23(30)12-14-28(22,6)27(24)13-15-29(25,26)7/h8,16,18,20-21,23-27,30H,9-15,17H2,1-7H3/b19-16+/t20-,21-,23?,24+,25-,26+,27+,28+,29-/m1/s1 |
| InChIKey | SXOOOXJHQQTJJY-RGFUMWOKSA-N |
| Molecular Weight | 412.702 g/mol |
| SMILES | OC1CC[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC=C2C1)[H])(CC[C@@]4([C@@](\C=C\([C@@](C(C)C)(C)[H])C)(C)[H])[H])[H])C)[H])C |
| SPLASH | splash10-014i-9521000000-f87ffe59d307b5ae256c |
| Source of Spectrum | SD-1992-0-0 |
| Wiley ID | 1374778 |