SpectraBase Spectrum ID |
51Zcd4QcRV4 |
Name |
1,4-benzenedicarboxylic acid, 2-[[[(1-methylethyl)(phenylmethyl)amino]carbonothioyl]amino]-, dimethyl 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 |
400.145678431 u |
Formula |
C21H24N2O4S |
InChI |
InChI=1S/C21H24N2O4S/c1-14(2)23(13-15-8-6-5-7-9-15)21(28)22-18-12-16(19(24)26-3)10-11-17(18)20(25)27-4/h5-12,14H,13H2,1-4H3,(H,22,28) |
InChIKey |
UFUMUTRNLMTFCX-UHFFFAOYSA-N |
Molecular Weight |
400.493 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_1015 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13239599 |