| SpectraBase Spectrum ID |
L2mGk0x9y3w |
| Name |
[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid, 4,7-dihydro-5-methyl-7-(4-nitrophenyl)-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 |
431.162725475 u |
| Formula |
C20H25N5O4S |
| InChI |
InChI=1S/C20H25N5O4S/c1-4-6-7-12-30-20-22-19-21-13(3)16(18(26)29-5-2)17(24(19)23-20)14-8-10-15(11-9-14)25(27)28/h8-11,17H,4-7,12H2,1-3H3,(H,21,22,23) |
| InChIKey |
ROAHELRALOHMOL-UHFFFAOYSA-N |
| Molecular Weight |
431.511 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_830 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13239271 |
![[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid, 4,7-dihydro-5-methyl-7-(4-nitrophenyl)-2-(pentylthio)-, ethyl ester](/api/spectrum/L2mGk0x9y3w/structure.png?h=300&w=458 "[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid, 4,7-dihydro-5-methyl-7-(4-nitrophenyl)-2-(pentylthio)-, ethyl ester")
