| SpectraBase Spectrum ID |
Eo6yJVGbF95 |
| Name |
[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid, 7-(4-chlorophenyl)-4,7-dihydro-5-methyl-2-(pentylthio)-, ethyl ester |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
420.138674933 u |
| Formula |
C20H25ClN4O2S |
| InChI |
InChI=1S/C20H25ClN4O2S/c1-4-6-7-12-28-20-23-19-22-13(3)16(18(26)27-5-2)17(25(19)24-20)14-8-10-15(21)11-9-14/h8-11,17H,4-7,12H2,1-3H3,(H,22,23,24) |
| InChIKey |
PPMNANJKFIBTCW-UHFFFAOYSA-N |
| Molecular Weight |
420.959 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_832 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13239276 |
![[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid, 7-(4-chlorophenyl)-4,7-dihydro-5-methyl-2-(pentylthio)-, ethyl ester](/api/spectrum/Eo6yJVGbF95/structure.png?h=300&w=458 "[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid, 7-(4-chlorophenyl)-4,7-dihydro-5-methyl-2-(pentylthio)-, ethyl ester")
