| SpectraBase Compound ID | 2XvFzN8IcaX |
|---|---|
| InChI | InChI=1S/C16H13NO3/c18-16(19)15-9-12-8-13(6-7-14(12)17-15)20-10-11-4-2-1-3-5-11/h1-9,17H,10H2,(H,18,19) |
| InChIKey | MVCLSAMNMAWXFQ-UHFFFAOYSA-N |
| Mol Weight | 267.28 g/mol |
| Molecular Formula | C16H13NO3 |
| Exact Mass | 267.089543 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9cDRe7tmNKI |
|---|---|
| Name | 5-Benzyloxyindole-2-carboxylic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 267.089543280 u |
| Formula | C16H13NO3 |
| InChI | InChI=1S/C16H13NO3/c18-16(19)15-9-12-8-13(6-7-14(12)17-15)20-10-11-4-2-1-3-5-11/h1-9,17H,10H2,(H,18,19) |
| InChIKey | MVCLSAMNMAWXFQ-UHFFFAOYSA-N |
| Molecular Weight | 267.284 g/mol |
| SMILES | C1=CC=2NC(=CC2C=C1OCC1=CC=CC=C1)C(O)=O |