SpectraBase Spectrum ID |
2NLqu4gbIG |
Name |
2H-1,3-thiazine-6-carboxylic acid, 2-[[4-(ethoxycarbonyl)phenyl]imino]-3-[2-(2-fluorophenyl)ethyl]-3,4-dihydro-4-oxo-, |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
456.115521116 u |
Formula |
C23H21FN2O5S |
InChI |
InChI=1S/C23H21FN2O5S/c1-3-31-21(28)16-8-10-17(11-9-16)25-23-26(13-12-15-6-4-5-7-18(15)24)20(27)14-19(32-23)22(29)30-2/h4-11,14H,3,12-13H2,1-2H3/b25-23- |
InChIKey |
YQZMHFUNURWWDS-BZZOAKBMSA-N |
Molecular Weight |
456.488 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_2098 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13236565; Lab Info: PE; Lab Number: PE-0403060 |