| SpectraBase Compound ID | FyndOb6CC9F |
|---|---|
| InChI | InChI=1S/C19H17NO3/c1-12-19(13(2)21)17-11-16(23-14(3)22)9-10-18(17)20(12)15-7-5-4-6-8-15/h4-11H,1-3H3 |
| InChIKey | KNHYUQGXTZHCSY-UHFFFAOYSA-N |
| Mol Weight | 307.35 g/mol |
| Molecular Formula | C19H17NO3 |
| Exact Mass | 307.120843 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Jt7LluxtLoL |
|---|---|
| Name | 1-Phenyl-2-methyl-3-acetyl-5-acetoxyindole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 307.120843408 u |
| Formula | C19H17NO3 |
| InChI | InChI=1S/C19H17NO3/c1-12-19(13(2)21)17-11-16(23-14(3)22)9-10-18(17)20(12)15-7-5-4-6-8-15/h4-11H,1-3H3 |
| InChIKey | KNHYUQGXTZHCSY-UHFFFAOYSA-N |
| Molecular Weight | 307.349 g/mol |
| SMILES | C=1(N(c2c(C1C(=O)C)cc(cc2)OC(=O)C)c1ccccc1)C |