| SpectraBase Spectrum ID |
EJ9ZTW60V5P |
| Name |
2,4-thiophenedicarboxylic acid, 5-[[3-[(hexahydro-1H-azepin-1-yl)sulfonyl]benzoyl]amino]-3-methyl-, diethyl 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 |
522.149443655 u |
| Formula |
C24H30N2O7S2 |
| InChI |
InChI=1S/C24H30N2O7S2/c1-4-32-23(28)19-16(3)20(24(29)33-5-2)34-22(19)25-21(27)17-11-10-12-18(15-17)35(30,31)26-13-8-6-7-9-14-26/h10-12,15H,4-9,13-14H2,1-3H3,(H,25,27) |
| InChIKey |
XTDAKJZFYDRQAV-UHFFFAOYSA-N |
| Molecular Weight |
522.631 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_948 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/8109666; Lab Info: SP; Lab Number: SP-0002331 |
![2,4-thiophenedicarboxylic acid, 5-[[3-[(hexahydro-1H-azepin-1-yl)sulfonyl]benzoyl]amino]-3-methyl-, diethyl ester](/api/spectrum/EJ9ZTW60V5P/structure.png?h=300&w=458 "2,4-thiophenedicarboxylic acid, 5-[[3-[(hexahydro-1H-azepin-1-yl)sulfonyl]benzoyl]amino]-3-methyl-, diethyl ester")
