| SpectraBase Compound ID | DR7U3XiPAvu |
|---|---|
| InChI | InChI=1S/C20H32O3/c1-5-16(2)11-15-20(23-15)18(4)9-6-8-17(3,13-21)14(18)7-10-19(20,22)12-16/h5,14-15,21-22H,1,6-13H2,2-4H3/t14?,15-,16-,17+,18-,19-,20+/m1/s1 |
| InChIKey | IWNAABFLTZNYLE-MOTVNDDHSA-N |
| Mol Weight | 320.5 g/mol |
| Molecular Formula | C20H32O3 |
| Exact Mass | 320.235145 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | I8IZkIKXWZt |
|---|---|
| Name | 8-alpha,19-Dihydroxy-9-alpha,10-.alpha.-epoxy-13-epi-(ent)-pimara-15-ene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 320.235144887 u |
| Formula | C20H32O3 |
| InChI | InChI=1S/C20H32O3/c1-5-16(2)11-15-20(23-15)18(4)9-6-8-17(3,13-21)14(18)7-10-19(20,22)12-16/h5,14-15,21-22H,1,6-13H2,2-4H3/t14?,15-,16-,17+,18-,19-,20+/m1/s1 |
| InChIKey | IWNAABFLTZNYLE-MOTVNDDHSA-N |
| Molecular Weight | 320.473 g/mol |
| SMILES | [C@@]123O[C@@]3(C[C@](C[C@@]1(CCC1[C@]2(CCC[C@]1(CO)C)C)O)(C=C)C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.908585 |