| SpectraBase Spectrum ID |
APK7RukBEKF |
| Name |
benzoic acid, 2-[[[[1-[4-(propoxycarbonyl)phenyl]-1H-tetrazol-5-yl]thio]acetyl]amino]-, 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 |
455.126339965 u |
| Formula |
C21H21N5O5S |
| InChI |
InChI=1S/C21H21N5O5S/c1-3-12-31-19(28)14-8-10-15(11-9-14)26-21(23-24-25-26)32-13-18(27)22-17-7-5-4-6-16(17)20(29)30-2/h4-11H,3,12-13H2,1-2H3,(H,22,27) |
| InChIKey |
AIZCYQFYCHWTRB-UHFFFAOYSA-N |
| Molecular Weight |
455.489 g/mol |
| NMR Offset |
17.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_6586 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9302367; Lab Info: LP; Lab Number: LP-3701076 |
![benzoic acid, 2-[[[[1-[4-(propoxycarbonyl)phenyl]-1H-tetrazol-5-yl]thio]acetyl]amino]-, methyl ester](/api/spectrum/APK7RukBEKF/structure.png?h=300&w=458 "benzoic acid, 2-[[[[1-[4-(propoxycarbonyl)phenyl]-1H-tetrazol-5-yl]thio]acetyl]amino]-, methyl ester")
