![1H-Indole-2,3-dione, 1-[[3-(trifluoromethyl)phenyl]methyl]-](/api/spectrum/Eus27zsFXSk/structure.png?h=300&w=458 "1H-Indole-2,3-dione, 1-[[3-(trifluoromethyl)phenyl]methyl]-")
| SpectraBase Compound ID | Ca0E43TzS5n |
|---|---|
| InChI | InChI=1S/C16H10F3NO2/c17-16(18,19)11-5-3-4-10(8-11)9-20-13-7-2-1-6-12(13)14(21)15(20)22/h1-8H,9H2 |
| InChIKey | RTFGNLKMQZLCET-UHFFFAOYSA-N |
| Mol Weight | 305.26 g/mol |
| Molecular Formula | C16H10F3NO2 |
| Exact Mass | 305.066363 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Eus27zsFXSk |
|---|---|
| Name | 1H-Indole-2,3-dione, 1-[[3-(trifluoromethyl)phenyl]methyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 305.066363053 u |
| Formula | C16H10F3NO2 |
| InChI | InChI=1S/C16H10F3NO2/c17-16(18,19)11-5-3-4-10(8-11)9-20-13-7-2-1-6-12(13)14(21)15(20)22/h1-8H,9H2 |
| InChIKey | RTFGNLKMQZLCET-UHFFFAOYSA-N |
| Molecular Weight | 305.256 g/mol |
| SMILES | C(N1C(C(C=2C1=CC=CC2)=O)=O)C1=CC(=CC=C1)C(F)(F)F |