| SpectraBase Spectrum ID |
K2JXMOWoDmK |
| Name |
benzo[b]thiophene-2-carboxylic acid, 3-(acetylamino)-6-nitro-4-[(phenylmethyl)thio]-, 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 |
430.065714031 u |
| Formula |
C20H18N2O5S2 |
| InChI |
InChI=1S/C20H18N2O5S2/c1-3-27-20(24)19-18(21-12(2)23)17-15(28-11-13-7-5-4-6-8-13)9-14(22(25)26)10-16(17)29-19/h4-10H,3,11H2,1-2H3,(H,21,23) |
| InChIKey |
MMTQPFJGLBVICG-UHFFFAOYSA-N |
| Molecular Weight |
430.493 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_16694 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10320359; Lab Info: DAL; Lab Number: DAL-01010036 |
