| SpectraBase Spectrum ID |
ISvuUI8HaGw |
| Name |
benzoic acid, 3-iodo-, 4-(6-methyl-2-benzothiazolyl)phenyl 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 |
470.978994867 u |
| Formula |
C21H14INO2S |
| InChI |
InChI=1S/C21H14INO2S/c1-13-5-10-18-19(11-13)26-20(23-18)14-6-8-17(9-7-14)25-21(24)15-3-2-4-16(22)12-15/h2-12H,1H3 |
| InChIKey |
OHFFNVREDBKDHR-UHFFFAOYSA-N |
| Molecular Weight |
471.312 g/mol |
| NMR Offset |
16.2999 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_2946 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9248450; Lab Info: *1040037*; Lab Number: *1040037* |
| Temperature |
29.85 °C |
