SpectraBase Spectrum ID |
I21mkoRN7OU |
Name |
4H-1,2,4-triazole-3-thiol, 5-[(3,4-dimethylphenoxy)methyl]-4-phenyl- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
311.109233352 u |
Formula |
C17H17N3OS |
InChI |
InChI=1S/C17H17N3OS/c1-12-8-9-15(10-13(12)2)21-11-16-18-19-17(22)20(16)14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H,19,22) |
InChIKey |
XKOMOXOMLWWMDO-UHFFFAOYSA-N |
Molecular Weight |
311.403 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_14079 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10300280; Lab Info: LP; Lab Number: LP-217984 |