| SpectraBase Compound ID | CNyl868Ufp9 |
|---|---|
| InChI | InChI=1S/C30H50O/c1-20(2)10-9-11-21(3)22-14-18-30(8)24-12-13-25-27(4,5)26(31)16-17-28(25,6)23(24)15-19-29(22,30)7/h10,21-22,25-26,31H,9,11-19H2,1-8H3/t21-,22+,25?,26-,28+,29-,30+/m0/s1 |
| InChIKey | CAHGCLMLTWQZNJ-MRXVSIFQSA-N |
| Mol Weight | 426.7 g/mol |
| Molecular Formula | C30H50O |
| Exact Mass | 426.386166 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8ezPHU8Jnhn |
|---|---|
| Name | Tirucallol |
| CAS Registry Number | 514-46-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H50O |
| InChI | InChI=1S/C30H50O/c1-20(2)10-9-11-21(3)22-14-18-30(8)24-12-13-25-27(4,5)26(31)16-17-28(25,6)23(24)15-19-29(22,30)7/h10,21-22,25-26,31H,9,11-19H2,1-8H3/t21-,22+,25?,26-,28+,29-,30+/m0/s1 |
| InChIKey | CAHGCLMLTWQZNJ-MRXVSIFQSA-N |
| Molecular Weight | 426.729 g/mol |
| SMILES | O[C@@]1(C(C2CCC=3[C@@]4([C@]([C@@]([C@](CCC=C(C)C)(C)[H])(CC4)[H])(CCC3[C@]2(CC1)C)C)C)(C)C)[H] |
| SPLASH | splash10-03di-4302900000-3bc51ce5f39372a4dd89 |
| Source of Spectrum | Va-0-0-0 |
| Wiley ID | 738904 |