SpectraBase Spectrum ID |
OrvtwKMzhA |
Name |
ethanone, 1-[5-[2-[(2-chlorophenyl)methoxy]-3-methoxyphenyl]-4-(3,4-dimethylphenyl)-4,5-dihydro-1-phenyl-1H-1,2,4-triazol-3-yl]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
539.197569535 u |
Formula |
C32H30ClN3O3 |
InChI |
InChI=1S/C32H30ClN3O3/c1-21-17-18-26(19-22(21)2)35-31(23(3)37)34-36(25-12-6-5-7-13-25)32(35)27-14-10-16-29(38-4)30(27)39-20-24-11-8-9-15-28(24)33/h5-19,32H,20H2,1-4H3 |
InChIKey |
YGJRKSZICWLHKC-UHFFFAOYSA-N |
Molecular Weight |
540.063 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_7296 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10222721; Lab Info: LP; Lab Number: LP-3900046 |
Temperature |
29.85 °C |