| SpectraBase Spectrum ID |
FinCMFIII87 |
| Name |
benzoic acid, 4-[5-[[2-[(2-ethyl-6-methylphenyl)amino]-2-oxoethyl]thio]-1H-tetrazol-1-yl]-, 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 |
411.136510727 u |
| Formula |
C20H21N5O3S |
| InChI |
InChI=1S/C20H21N5O3S/c1-4-14-7-5-6-13(2)18(14)21-17(26)12-29-20-22-23-24-25(20)16-10-8-15(9-11-16)19(27)28-3/h5-11H,4,12H2,1-3H3,(H,21,26) |
| InChIKey |
RYXRQHTYBSCYNB-UHFFFAOYSA-N |
| Molecular Weight |
411.480 g/mol |
| NMR Offset |
17.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_6584 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9291367; Lab Info: LP; Lab Number: LP-3701069 |
![benzoic acid, 4-[5-[[2-[(2-ethyl-6-methylphenyl)amino]-2-oxoethyl]thio]-1H-tetrazol-1-yl]-, methyl ester](/api/spectrum/FinCMFIII87/structure.png?h=300&w=458 "benzoic acid, 4-[5-[[2-[(2-ethyl-6-methylphenyl)amino]-2-oxoethyl]thio]-1H-tetrazol-1-yl]-, methyl ester")
