SpectraBase Spectrum ID |
661eU1PYsBD |
Name |
benzenepropanoic acid, 4-methyl-beta-[[(2-methyl-5-nitrophenyl)sulfonyl]amino]-, 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 |
406.119857604 u |
Formula |
C19H22N2O6S |
InChI |
InChI=1S/C19H22N2O6S/c1-4-27-19(22)12-17(15-8-5-13(2)6-9-15)20-28(25,26)18-11-16(21(23)24)10-7-14(18)3/h5-11,17,20H,4,12H2,1-3H3 |
InChIKey |
XQLXHKALSNQUIX-UHFFFAOYSA-N |
Molecular Weight |
406.453 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_16864 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/11260780; Lab Info: DK; Lab Number: DK-0021158 |