| SpectraBase Spectrum ID |
C0H6U0s1vV6 |
| Name |
benzamide, 4-chloro-N-[1-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
495.060679998 u |
| Formula |
C20H16ClF6N3OS |
| InChI |
InChI=1S/C20H16ClF6N3OS/c21-12-8-6-11(7-9-12)16(31)29-18(19(22,23)24,20(25,26)27)30-17-14(10-28)13-4-2-1-3-5-15(13)32-17/h6-9,30H,1-5H2,(H,29,31) |
| InChIKey |
CHILUWNYVQCYJT-UHFFFAOYSA-N |
| Molecular Weight |
495.871 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_8295 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9321646; Lab Info: AU; Lab Number: AU-t000761 |
| Temperature |
29.85 °C |
![benzamide, 4-chloro-N-[1-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-](/api/spectrum/C0H6U0s1vV6/structure.png?h=300&w=458 "benzamide, 4-chloro-N-[1-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-")
