| SpectraBase Compound ID | EVApSPiTea |
|---|---|
| InChI | InChI=1S/C15H20O4/c1-7-9(16)4-5-15(3)6-10(17)11-8(2)14(18)19-13(11)12(7)15/h4-5,7-8,10-13,17H,6H2,1-3H3/t7?,8-,10-,11+,12?,13+,15+/m0/s1 |
| InChIKey | NTRPADFVIYCORM-ZITMPNRGSA-N |
| Mol Weight | 264.32 g/mol |
| Molecular Formula | C15H20O4 |
| Exact Mass | 264.136159 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5NLZfvSuMN7 |
|---|---|
| Name | 1,2-Dihydro-6-epiartemisin |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 264.136159120 u |
| Formula | C15H20O4 |
| InChI | InChI=1S/C15H20O4/c1-7-9(16)4-5-15(3)6-10(17)11-8(2)14(18)19-13(11)12(7)15/h4-5,7-8,10-13,17H,6H2,1-3H3/t7?,8-,10-,11+,12?,13+,15+/m0/s1 |
| InChIKey | NTRPADFVIYCORM-ZITMPNRGSA-N |
| Molecular Weight | 264.321 g/mol |
| SMILES | [C@@]12(OC(=O)[C@]([C@@]2([C@@](O)(C[C@@]2(C1C(C(C=C2)=O)C)C)[H])[H])(C)[H])[H] |