| SpectraBase Spectrum ID |
FegvYveSuSR |
| Name |
benzoic acid, 4-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-,methyl 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 |
280.034019980 u |
| Formula |
C12H12N2O2S2 |
| InChI |
InChI=1S/C12H12N2O2S2/c1-8-13-14-12(18-8)17-7-9-3-5-10(6-4-9)11(15)16-2/h3-6H,7H2,1-2H3 |
| InChIKey |
IJCRIPJXXKVIQV-UHFFFAOYSA-N |
| Molecular Weight |
280.360 g/mol |
| NMR Offset |
18.8257 |
| NMR Spectrometer Frequency |
250.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_2176 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9233438; Lab Info: PNA; Lab Number: PNA-NA00122 |
| Temperature |
23.85 °C |
![Benzoic acid, 4-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-, methyl ester](/api/spectrum/FegvYveSuSR/structure.png?h=300&w=458 "Benzoic acid, 4-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-, methyl ester")
