| SpectraBase Spectrum ID |
9tPBuybl6SI |
| Name |
3-pyridinecarbonitrile, 2-amino-1-(3-cyano-4-ethyl-5-methyl-2-thienyl)-1,4-dihydro-6-methyl-4,4-bis(trifluoromethyl)- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
420.084336619 u |
| Formula |
C17H14F6N4S |
| InChI |
InChI=1S/C17H14F6N4S/c1-4-10-9(3)28-14(11(10)6-24)27-8(2)5-15(16(18,19)20,17(21,22)23)12(7-25)13(27)26/h5H,4,26H2,1-3H3 |
| InChIKey |
PQXKIVFRDGFWED-UHFFFAOYSA-N |
| Molecular Weight |
420.377 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_4349 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9290700; Lab Info: AU; Lab Number: AU-0000406 |
| Temperature |
29.85 °C |
