| SpectraBase Spectrum ID |
7zl7hoYpEtl |
| Name |
benzo[b]thiophene-3-carboxylic acid, 2-(acetylamino)-6-bromo-7-[2-[(2,6-dimethylphenyl)amino]-2-oxoethoxy]-, ethyl 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 |
518.051106018 u |
| Formula |
C23H23BrN2O5S |
| InChI |
InChI=1S/C23H23BrN2O5S/c1-5-30-23(29)18-15-9-10-16(24)20(21(15)32-22(18)25-14(4)27)31-11-17(28)26-19-12(2)7-6-8-13(19)3/h6-10H,5,11H2,1-4H3,(H,25,27)(H,26,28) |
| InChIKey |
PIZRYGOAHLKWDV-UHFFFAOYSA-N |
| Molecular Weight |
519.410 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_3166 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9258570; Lab Info: *1041782*; Lab Number: BAS 1041782 |
| Temperature |
29.85 °C |
![benzo[b]thiophene-3-carboxylic acid, 2-(acetylamino)-6-bromo-7-[2-[(2,6-dimethylphenyl)amino]-2-oxoethoxy]-, ethyl ester](/api/spectrum/7zl7hoYpEtl/structure.png?h=300&w=458 "benzo[b]thiophene-3-carboxylic acid, 2-(acetylamino)-6-bromo-7-[2-[(2,6-dimethylphenyl)amino]-2-oxoethoxy]-, ethyl ester")
