SpectraBase Spectrum ID |
Isuvpf3GRFs |
Name |
benzenecarbothioic acid, 4-methyl-, S-[4-[4-[(4-methylbenzoyl)thio]phenoxy]phenyl] ester |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
470.101036913 u |
Formula |
C28H22O3S2 |
InChI |
InChI=1S/C28H22O3S2/c1-19-3-7-21(8-4-19)27(29)32-25-15-11-23(12-16-25)31-24-13-17-26(18-14-24)33-28(30)22-9-5-20(2)6-10-22/h3-18H,1-2H3 |
InChIKey |
BZAMEKHLGJSIFK-UHFFFAOYSA-N |
Molecular Weight |
470.601 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_7749 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10231137; Lab Info: AI; Lab Number: AIS-S001188 |
Temperature |
23.85 °C |