SpectraBase Spectrum ID |
IFIAuFLNjBL |
Name |
3-penten-2-one, 3-[[5-(2-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-4-hydroxy-, (3E)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
385.065175639 u |
Formula |
C19H16ClN3O2S |
InChI |
InChI=1S/C19H16ClN3O2S/c1-12(24)17(13(2)25)26-19-22-21-18(15-10-6-7-11-16(15)20)23(19)14-8-4-3-5-9-14/h3-11,24H,1-2H3/b17-12+ |
InChIKey |
FHQVYPYFONNOOD-SFQUDFHCSA-N |
Molecular Weight |
385.869 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_3505 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9234684; Lab Info: LP; Lab Number: LP-2190515 |
Temperature |
29.85 °C |