SpectraBase Spectrum ID |
1OXV2wrSDN7 |
Name |
benzo[b]thiophene-2-carboxylic acid, 3-amino-6-[(2-methoxy-2-oxoethyl)thio]-, 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 |
311.028600247 u |
Formula |
C13H13NO4S2 |
InChI |
InChI=1S/C13H13NO4S2/c1-17-10(15)6-19-7-3-4-8-9(5-7)20-12(11(8)14)13(16)18-2/h3-5H,6,14H2,1-2H3 |
InChIKey |
HRBLJSMGUKRBPH-UHFFFAOYSA-N |
Molecular Weight |
311.370 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_16526 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/11250921; Lab Info: L-12; Lab Number: ZLOT-0000005 |