SpectraBase Spectrum ID |
BBGbW5UveYv |
Name |
benzoic acid, 4-methoxy-, 2-methoxy-4-[(4-methyl-1-piperidinyl)carbonothioyl]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 |
399.150429459 u |
Formula |
C22H25NO4S |
InChI |
InChI=1S/C22H25NO4S/c1-15-10-12-23(13-11-15)21(28)17-6-9-19(20(14-17)26-3)27-22(24)16-4-7-18(25-2)8-5-16/h4-9,14-15H,10-13H2,1-3H3 |
InChIKey |
XRXCSPJKFLAIIO-UHFFFAOYSA-N |
Molecular Weight |
399.505 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_1969 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: ZI/8127230; Lab Info: LD; Lab Number: LD-0500185 |
Temperature |
29.85 °C |