| SpectraBase Spectrum ID |
Fn0rX6Il1hW |
| Name |
methyl 3-{[4-(3,4-dihydro-2(1H)-isoquinolinyl)-6-(2-fluoroanilino)-1,3,5-triazin-2-yl]oxy}benzoate |
| Copyright |
Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
471.170667748 u |
| Formula |
C26H22FN5O3 |
| InChI |
InChI=1S/C26H22FN5O3/c1-34-23(33)18-9-6-10-20(15-18)35-26-30-24(28-22-12-5-4-11-21(22)27)29-25(31-26)32-14-13-17-7-2-3-8-19(17)16-32/h2-12,15H,13-14,16H2,1H3,(H,28,29,30,31) |
| InChIKey |
WOHRGIMLXPUAOH-UHFFFAOYSA-N |
| Molecular Weight |
471.492 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_8767 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13228045 |
![3-[[4-(3,4-dihydro-1H-isoquinolin-2-yl)-6-(2-fluoroanilino)-1,3,5-triazin-2-yl]oxy]benzoic acid methyl ester](/api/spectrum/Fn0rX6Il1hW/structure.png?h=300&w=458 "3-[[4-(3,4-dihydro-1H-isoquinolin-2-yl)-6-(2-fluoroanilino)-1,3,5-triazin-2-yl]oxy]benzoic acid methyl ester")
