| SpectraBase Spectrum ID |
33ERRvMW6xm |
| Name |
[1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carboxylic acid, 1,4-dihydro-7-(methylthio)-4-oxo-, ethyl ester |
| Copyright |
Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
255.042610341 u |
| Formula |
C8H9N5O3S |
| InChI |
InChI=1S/C8H9N5O3S/c1-3-16-6(15)4-5(14)13-7(11-10-4)9-8(12-13)17-2/h3H2,1-2H3,(H,9,11,12) |
| InChIKey |
OKEGJZMZRCFUOB-UHFFFAOYSA-N |
| Molecular Weight |
255.252 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_6718 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13263167; Lab Info: Ulomsky E.N., Deev S.L., Rusinov V.L., Chupakhin O.N.; Lab Number: JOC99/09186 |
![[1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carboxylic acid, 1,4-dihydro-7-(methylthio)-4-oxo-, ethyl ester](/api/spectrum/33ERRvMW6xm/structure.png?h=300&w=458 "[1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carboxylic acid, 1,4-dihydro-7-(methylthio)-4-oxo-, ethyl ester")
