| SpectraBase Spectrum ID |
6E6i2MFs5sm |
| Name |
benzoic acid, 4-[[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-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 |
364.099396943 u |
| Formula |
C19H16N4O2S |
| InChI |
InChI=1S/C19H16N4O2S/c1-23-15-6-4-3-5-14(15)16-17(23)20-19(22-21-16)26-11-12-7-9-13(10-8-12)18(24)25-2/h3-10H,11H2,1-2H3 |
| InChIKey |
BVNXGOAXQYBMHL-UHFFFAOYSA-N |
| Molecular Weight |
364.423 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_17788 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/11240271; Lab Info: SAD; Lab Number: 110 |
![benzoic acid, 4-[[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio]methyl]-, methyl ester](/api/spectrum/6E6i2MFs5sm/structure.png?h=300&w=458 "benzoic acid, 4-[[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio]methyl]-, methyl ester")
