SpectraBase Spectrum ID |
IA5TQadXD7p |
Name |
Methyl 2-[isobutyl(p-tolylsulfonyl)carbamoyl]-3-phenyl-prop-2-enoate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H25NO5S |
InChI |
InChI=1S/C22H25NO5S/c1-16(2)15-23(29(26,27)19-12-10-17(3)11-13-19)21(24)20(22(25)28-4)14-18-8-6-5-7-9-18/h5-14,16H,15H2,1-4H3 |
InChIKey |
WALPIVLGOCBOST-UHFFFAOYSA-N |
Instrument Name |
Shimadzu GC-2010-QP2010 |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/acs.orglett.1c00952 |
Molecular Weight |
415.504 g/mol |
SMILES |
C(C(C(=O)OC)=Cc1ccccc1)(=O)N(CC(C)C)S(c1ccc(C)cc1)(=O)=O |
SPLASH |
splash10-007c-2920000000-5ed919954ee2d0a20b0f |
Source of Spectrum |
A1-23-SM181-8 |
Wiley ID |
1870267 |