| SpectraBase Compound ID | AmnEVcUH0H2 |
|---|---|
| InChI | InChI=1S/C19H26O3/c1-18-10-5-11-19(2,17(20)22-4)16(18)9-7-13-6-8-14(21-3)12-15(13)18/h6,8,12,16H,5,7,9-11H2,1-4H3/t16-,18-,19+/m1/s1 |
| InChIKey | BSKWXDWRTACMCC-QRQLOZEOSA-N |
| Mol Weight | 302.41 g/mol |
| Molecular Formula | C19H26O3 |
| Exact Mass | 302.188195 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | CimAe0WlYwI |
|---|---|
| Name | Methyl-12-o-podocarpate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.188194694 u |
| Formula | C19H26O3 |
| InChI | InChI=1S/C19H26O3/c1-18-10-5-11-19(2,17(20)22-4)16(18)9-7-13-6-8-14(21-3)12-15(13)18/h6,8,12,16H,5,7,9-11H2,1-4H3/t16-,18-,19+/m1/s1 |
| InChIKey | BSKWXDWRTACMCC-QRQLOZEOSA-N |
| SMILES | C(=O)([C@@]1([C@]2([C@@](C3=C(CC2)C=CC(=C3)OC)(CCC1)C)[H])C)OC |
| Spectrum/Structure Validation Score (Raman) | 0.933569 |