| SpectraBase Compound ID | DvUbjyQcgpt |
|---|---|
| InChI | InChI=1S/C29H48O2/c1-7-29(31,19(2)3)17-12-20(4)24-10-11-25-23-9-8-21-18-22(30)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-8,19-20,22-26,30-31H,1,9-18H2,2-6H3/t20-,22+,23+,24-,25?,26?,27+,28-,29?/m1/s1 |
| InChIKey | OPGVEUGCNGNPSX-NKTCOFDGSA-N |
| Mol Weight | 428.7 g/mol |
| Molecular Formula | C29H48O2 |
| Exact Mass | 428.365431 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | E2pqtnUa7xJ |
|---|---|
| Name | Saringo sterol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 428.365430784 u |
| Formula | C29H48O2 |
| InChI | InChI=1S/C29H48O2/c1-7-29(31,19(2)3)17-12-20(4)24-10-11-25-23-9-8-21-18-22(30)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-8,19-20,22-26,30-31H,1,9-18H2,2-6H3/t20-,22+,23+,24-,25?,26?,27+,28-,29?/m1/s1 |
| InChIKey | OPGVEUGCNGNPSX-NKTCOFDGSA-N |
| Molecular Weight | 428.701 g/mol |
| SMILES | [C@@]12(C([C@@]3(CC=C4[C@@](C3CC2)(CC[C@](O)(C4)[H])C)[H])CC[C@@]1([C@@](CCC(C=C)(C(C)C)O)(C)[H])[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.845299 |