| SpectraBase Compound ID | GBRAQinwdfc |
|---|---|
| InChI | InChI=1S/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14-,15+,16+,17+,18+,19+,20-/m1/s1 |
| InChIKey | XYPPDQHBNJURHU-IPOQXWOTSA-N |
| Mol Weight | 356.5 g/mol |
| Molecular Formula | C20H36O5 |
| Exact Mass | 356.256274 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | JhYuCza7GUF |
|---|---|
| Name | Lasiocoryintetraol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 356.256274254 u |
| Formula | C20H36O5 |
| InChI | InChI=1S/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14-,15+,16+,17+,18+,19+,20-/m1/s1 |
| InChIKey | XYPPDQHBNJURHU-IPOQXWOTSA-N |
| Molecular Weight | 356.503 g/mol |
| SMILES | [C@]12([C@]3(O[C@@](CCO)(CO)CC3)[C@](C)(CC[C@]1([C@@](CO)(C)[C@](CC2)(O)[H])[H])[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.939773 |