| SpectraBase Compound ID | CviSYnzGQyh |
|---|---|
| InChI | InChI=1S/C20H28O4/c1-18(2)15-7-6-12-10-19(3,17(23)24-5)9-8-13(12)20(15,4)11-14(21)16(18)22/h6,11,13,15,21H,7-10H2,1-5H3/t13?,15-,19+,20+/m0/s1 |
| InChIKey | ZEVAQFRHFKXWIF-HASHIUCYSA-N |
| Mol Weight | 332.44 g/mol |
| Molecular Formula | C20H28O4 |
| Exact Mass | 332.198759 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4oxS7GDUN2f |
|---|---|
| Name | Methyl 16-norisopimara-1,7-dien-2-ol-3-on-15-oate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 332.198759378 u |
| Formula | C20H28O4 |
| InChI | InChI=1S/C20H28O4/c1-18(2)15-7-6-12-10-19(3,17(23)24-5)9-8-13(12)20(15,4)11-14(21)16(18)22/h6,11,13,15,21H,7-10H2,1-5H3/t13?,15-,19+,20+/m0/s1 |
| InChIKey | ZEVAQFRHFKXWIF-HASHIUCYSA-N |
| Molecular Weight | 332.440 g/mol |
| SMILES | [C@]12(C=C(O)C(C([C@@]2(CC=C2C1CC[C@](C(=O)OC)(C)C2)[H])(C)C)=O)C |