| SpectraBase Compound ID | 5ib00rZqTiA |
|---|---|
| InChI | InChI=1S/C16H11NO3/c18-16-12(11-3-1-2-4-13(11)17-16)7-10-5-6-14-15(8-10)20-9-19-14/h1-8H,9H2,(H,17,18) |
| InChIKey | UBOQMVKWCXXWIP-UHFFFAOYSA-N |
| Mol Weight | 265.27 g/mol |
| Molecular Formula | C16H11NO3 |
| Exact Mass | 265.073893 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | Fak9ERMLbW2 |
|---|---|
| Name | 3-Piperonylidene-2-indolinone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 265.073893215 u |
| Formula | C16H11NO3 |
| InChI | InChI=1S/C16H11NO3/c18-16-12(11-3-1-2-4-13(11)17-16)7-10-5-6-14-15(8-10)20-9-19-14/h1-8H,9H2,(H,17,18) |
| InChIKey | UBOQMVKWCXXWIP-UHFFFAOYSA-N |
| SMILES | N1C=2C=CC=CC2C(C1=O)=CC=1C=CC=2OCOC2C1 |
| Spectrum/Structure Validation Score (Raman) | 0.973709 |