SpectraBase Spectrum ID |
8xKJcMjN0lo |
Name |
benzoic acid, 4-[3-[2-(3,4-diethoxyphenyl)ethyl]-4-[2-[(4-methoxyphenyl)amino]-2-oxoethyl]-5-oxo-2-thioxo-1-imidazolidinyl]-, ethyl 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 |
619.235221710 u |
Formula |
C33H37N3O7S |
InChI |
InChI=1S/C33H37N3O7S/c1-5-41-28-17-8-22(20-29(28)42-6-2)18-19-35-27(21-30(37)34-24-11-15-26(40-4)16-12-24)31(38)36(33(35)44)25-13-9-23(10-14-25)32(39)43-7-3/h8-17,20,27H,5-7,18-19,21H2,1-4H3,(H,34,37) |
InChIKey |
KSSYIACGXKHYSS-UHFFFAOYSA-N |
Molecular Weight |
619.733 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_15061 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/11230172; Lab Info: PE; Lab Number: 2MR56D17 |