| SpectraBase Compound ID | 5aYtq08fO4d |
|---|---|
| InChI | InChI=1S/C13H17NO5/c1-6-10(19-7(2)15)4-8-9(13(17)18-3)5-14-12(16)11(6)8/h5-6,8,10-11H,4H2,1-3H3,(H,14,16)/t6-,8+,10-,11+/m0/s1 |
| InChIKey | CCQYHPKBPFYGEX-BLMCLJNJSA-N |
| Mol Weight | 267.28 g/mol |
| Molecular Formula | C13H17NO5 |
| Exact Mass | 267.110673 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Fko4gBMzp1I |
|---|---|
| Name | 7-O-acetyl-stychnovoline |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H17NO5 |
| InChI | InChI=1S/C13H17NO5/c1-6-10(19-7(2)15)4-8-9(13(17)18-3)5-14-12(16)11(6)8/h5-6,8,10-11H,4H2,1-3H3,(H,14,16)/t6-,8+,10-,11+/m0/s1 |
| InChIKey | CCQYHPKBPFYGEX-BLMCLJNJSA-N |
| Molecular Weight | 267.281 g/mol |
| SMILES | N1C([C@]2([C@@](C(=C1)C(=O)OC)(C[C@@]([C@@]2(C)[H])(OC(=O)C)[H])[H])[H])=O |
| SPLASH | splash10-0006-9630000000-bc8ebb20d41154490db8 |
| Source of Spectrum | X2-48-91-9 |
| Wiley ID | 1601618 |