![2-{3-[(E)-(1-(2-fluorophenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-1H-indol-1-yl}-N-(3-methoxypropyl)acetamide](/api/spectrum/962QDRqRHFS/structure.png?h=300&w=458 "2-{3-[(E)-(1-(2-fluorophenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-1H-indol-1-yl}-N-(3-methoxypropyl)acetamide")
| SpectraBase Compound ID | 4TN7HsAVAjL |
|---|---|
| InChI | InChI=1S/C25H23FN4O5/c1-35-12-6-11-27-22(31)15-29-14-16(17-7-2-4-9-20(17)29)13-18-23(32)28-25(34)30(24(18)33)21-10-5-3-8-19(21)26/h2-5,7-10,13-14H,6,11-12,15H2,1H3,(H,27,31)(H,28,32,34)/b18-13+ |
| InChIKey | VSDVYDUKJVIAAR-QGOAFFKASA-N |
| Mol Weight | 478.48 g/mol |
| Molecular Formula | C25H23FN4O5 |
| Exact Mass | 478.165248 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 962QDRqRHFS |
|---|---|
| Name | 2-{3-[(E)-(1-(2-fluorophenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-1H-indol-1-yl}-N-(3-methoxypropyl)acetamide |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 478.165248015 u |
| Formula | C25H23FN4O5 |
| InChI | InChI=1S/C25H23FN4O5/c1-35-12-6-11-27-22(31)15-29-14-16(17-7-2-4-9-20(17)29)13-18-23(32)28-25(34)30(24(18)33)21-10-5-3-8-19(21)26/h2-5,7-10,13-14H,6,11-12,15H2,1H3,(H,27,31)(H,28,32,34)/b18-13+ |
| InChIKey | VSDVYDUKJVIAAR-QGOAFFKASA-N |
| Molecular Weight | 478.480 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_2420 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12279432 |