| SpectraBase Spectrum ID |
qjYkg6wgfj |
| Name |
benzo[b]thiophene-3-carboxylic acid, 2-[(2-ethoxybenzoyl)amino]-6-ethyl-4,5,6,7-tetrahydro-, 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 |
401.166079523 u |
| Formula |
C22H27NO4S |
| InChI |
InChI=1S/C22H27NO4S/c1-4-14-11-12-16-18(13-14)28-21(19(16)22(25)27-6-3)23-20(24)15-9-7-8-10-17(15)26-5-2/h7-10,14H,4-6,11-13H2,1-3H3,(H,23,24) |
| InChIKey |
XIYIUDIOJFBPKM-UHFFFAOYSA-N |
| Molecular Weight |
401.521 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_15467 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/10023033; Lab Info: PNA; Lab Number: PNA-1991482 |
![benzo[b]thiophene-3-carboxylic acid, 2-[(2-ethoxybenzoyl)amino]-6-ethyl-4,5,6,7-tetrahydro-, ethyl ester](/api/spectrum/qjYkg6wgfj/structure.png?h=300&w=458 "benzo[b]thiophene-3-carboxylic acid, 2-[(2-ethoxybenzoyl)amino]-6-ethyl-4,5,6,7-tetrahydro-, ethyl ester")
