SpectraBase Spectrum ID |
IxW6DiPGmOe |
Name |
3-thiophenecarboxylic acid, 5-[[[4-(ethoxycarbonyl)phenyl]amino]carbonyl]-4-methyl-2-[(4-methyl-3- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
539.136235943 u |
Formula |
C26H25N3O8S |
InChI |
InChI=1S/C26H25N3O8S/c1-5-36-25(32)16-9-11-18(12-10-16)27-23(31)21-15(4)20(26(33)37-6-2)24(38-21)28-22(30)17-8-7-14(3)19(13-17)29(34)35/h7-13H,5-6H2,1-4H3,(H,27,31)(H,28,30) |
InChIKey |
IIJKTHIJWINLQD-UHFFFAOYSA-N |
Molecular Weight |
539.559 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_8041 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9243840; Lab Info: SAS; Lab Number: SAS-TST0975 |
Temperature |
29.85 °C |