| SpectraBase Spectrum ID |
H9WH6CmMziw |
| Name |
butanoic acid, 2-[(2,3,4,5-tetrahydro-3,5-dioxo-1,2,4-triazin-6-yl)thio]-, pentyl 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 |
301.109627274 u |
| Formula |
C12H19N3O4S |
| InChI |
InChI=1S/C12H19N3O4S/c1-3-5-6-7-19-11(17)8(4-2)20-10-9(16)13-12(18)15-14-10/h8H,3-7H2,1-2H3,(H2,13,15,16,18) |
| InChIKey |
CDTPCQIIDWZHNJ-UHFFFAOYSA-N |
| Molecular Weight |
301.361 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_3371 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9278549; Lab Number: BAS 0909610 |
| Temperature |
29.85 °C |
![butanoic acid, 2-[(2,3,4,5-tetrahydro-3,5-dioxo-1,2,4-triazin-6-yl)thio]-, pentyl ester](/api/spectrum/H9WH6CmMziw/structure.png?h=300&w=458 "butanoic acid, 2-[(2,3,4,5-tetrahydro-3,5-dioxo-1,2,4-triazin-6-yl)thio]-, pentyl ester")
