SpectraBase Spectrum ID |
Jh9iGgkCKgE |
Name |
3-thiophenecarboxylic acid, 2-[[1-(benzoylamino)-2,2,2-trifluoro-1-(methoxycarbonyl)ethyl]amino]-5-ethyl-4-phenyl-, 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 |
534.143627571 u |
Formula |
C26H25F3N2O5S |
InChI |
InChI=1S/C26H25F3N2O5S/c1-4-18-19(16-12-8-6-9-13-16)20(23(33)36-5-2)22(37-18)31-25(24(34)35-3,26(27,28)29)30-21(32)17-14-10-7-11-15-17/h6-15,31H,4-5H2,1-3H3,(H,30,32) |
InChIKey |
LGTDDKSHNZPKTR-UHFFFAOYSA-N |
Molecular Weight |
534.550 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_12220 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10260736; Lab Info: AU; Lab Number: AU-0000063 |