| SpectraBase Compound ID | H3VYNfuEKAq |
|---|---|
| InChI | InChI=1S/C19H30O5/c1-11(20)22-10-13-18(5)9-7-8-17(3,4)15(18)14(23-12(2)21)16-19(13,6)24-16/h13-16H,7-10H2,1-6H3/t13-,14+,15+,16+,18-,19-/m1/s1 |
| InChIKey | YCRMMLVUOBXKST-DYIPZHMLSA-N |
| Mol Weight | 338.44 g/mol |
| Molecular Formula | C19H30O5 |
| Exact Mass | 338.209324 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 5QigdVBo3aL |
|---|---|
| Name | Uvidin C, diacetate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 338.209324061 u |
| Formula | C19H30O5 |
| InChI | InChI=1S/C19H30O5/c1-11(20)22-10-13-18(5)9-7-8-17(3,4)15(18)14(23-12(2)21)16-19(13,6)24-16/h13-16H,7-10H2,1-6H3/t13-,14+,15+,16+,18-,19-/m1/s1 |
| InChIKey | YCRMMLVUOBXKST-DYIPZHMLSA-N |
| Molecular Weight | 338.444 g/mol |
| SMILES | C1CC([C@]2([C@](C1)([C@@](COC(=O)C)([C@@]1([C@]([C@]2(OC(=O)C)[H])(O1)[H])C)[H])C)[H])(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.969705 |