SpectraBase Spectrum ID |
JS8UbxoNZky |
Name |
2-propenenitrile, 3-[[(2-fluorophenyl)methyl]thio]-2-(phenylsulfonyl)-3-[(2,4,6-trimethylphenyl)amino]-, (2E)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
466.118498498 u |
Formula |
C25H23FN2O2S2 |
InChI |
InChI=1S/C25H23FN2O2S2/c1-17-13-18(2)24(19(3)14-17)28-25(31-16-20-9-7-8-12-22(20)26)23(15-27)32(29,30)21-10-5-4-6-11-21/h4-14,28H,16H2,1-3H3/b25-23+ |
InChIKey |
MKJFRKUVVORHRE-WJTDDFOZSA-N |
Molecular Weight |
466.589 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_4461 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13288078 |