| SpectraBase Spectrum ID |
7LkV1e0kzkN |
| Name |
benzo[b]thiophene-3-carboxylic acid, 2-[[2-(2-bromophenoxy)-1-oxopropyl]amino]-4,5,6,7-tetrahydro-, 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 |
437.029642298 u |
| Formula |
C19H20BrNO4S |
| InChI |
InChI=1S/C19H20BrNO4S/c1-11(25-14-9-5-4-8-13(14)20)17(22)21-18-16(19(23)24-2)12-7-3-6-10-15(12)26-18/h4-5,8-9,11H,3,6-7,10H2,1-2H3,(H,21,22) |
| InChIKey |
RVXNLBJHXVOUFO-UHFFFAOYSA-N |
| Molecular Weight |
438.336 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_12526 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/10020964; Lab Info: PNA; Lab Number: PNA-1991235 |
![benzo[b]thiophene-3-carboxylic acid, 2-[[2-(2-bromophenoxy)-1-oxopropyl]amino]-4,5,6,7-tetrahydro-, methyl ester](/api/spectrum/7LkV1e0kzkN/structure.png?h=300&w=458 "benzo[b]thiophene-3-carboxylic acid, 2-[[2-(2-bromophenoxy)-1-oxopropyl]amino]-4,5,6,7-tetrahydro-, methyl ester")
