| SpectraBase Spectrum ID |
DXl9PkBe4mB |
| Name |
acetic acid, [[5-(3-nitrophenyl)-4-(2-propenyl)-4H-1,2,4-triazol-3-yl]thio]- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
320.057926052 u |
| Formula |
C13H12N4O4S |
| InChI |
InChI=1S/C13H12N4O4S/c1-2-6-16-12(14-15-13(16)22-8-11(18)19)9-4-3-5-10(7-9)17(20)21/h2-5,7H,1,6,8H2,(H,18,19) |
| InChIKey |
KVJWYSYJYQHASM-UHFFFAOYSA-N |
| Molecular Weight |
320.323 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_8678 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9313769; Lab Info: LP; Lab Number: LP-2191627 |
| Temperature |
29.85 °C |
![acetic acid, [[5-(3-nitrophenyl)-4-(2-propenyl)-4H-1,2,4-triazol-3-yl]thio]-](/api/spectrum/DXl9PkBe4mB/structure.png?h=300&w=458 "acetic acid, [[5-(3-nitrophenyl)-4-(2-propenyl)-4H-1,2,4-triazol-3-yl]thio]-")
