| SpectraBase Spectrum ID |
3291uqMQr68 |
| Name |
1,2,4-triazine-6-propanoic acid, 4-amino-4,5-dihydro-3-[[2-[(3-methylphenyl)amino]-2-oxoethyl]thio]-5-oxo- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
363.100125217 u |
| Formula |
C15H17N5O4S |
| InChI |
InChI=1S/C15H17N5O4S/c1-9-3-2-4-10(7-9)17-12(21)8-25-15-19-18-11(5-6-13(22)23)14(24)20(15)16/h2-4,7H,5-6,8,16H2,1H3,(H,17,21)(H,22,23) |
| InChIKey |
ZSVOJXOJQXRHTH-UHFFFAOYSA-N |
| Molecular Weight |
363.392 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_16218 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10321088; Lab Info: DEM; Lab Number: DEM-0000208 |
![3-[4-amino-3-[2-(3-methylanilino)-2-oxo-ethyl]sulfanyl-5-oxo-1,2,4-triazin-6-yl]propanoic acid](/api/spectrum/3291uqMQr68/structure.png?h=300&w=458 "3-[4-amino-3-[2-(3-methylanilino)-2-oxo-ethyl]sulfanyl-5-oxo-1,2,4-triazin-6-yl]propanoic acid")
