SpectraBase Spectrum ID |
FsWqT5BwMWo |
Name |
5-Pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-6-methyl-2-oxo-4-[2-(phenylmethoxy)phenyl]-, 2-propenyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
378.157957192 u |
Formula |
C22H22N2O4 |
InChI |
InChI=1S/C22H22N2O4/c1-3-13-27-21(25)19-15(2)23-22(26)24-20(19)17-11-7-8-12-18(17)28-14-16-9-5-4-6-10-16/h3-12,20H,1,13-14H2,2H3,(H2,23,24,26) |
InChIKey |
VYRXHGMRFYWXRX-UHFFFAOYSA-N |
Molecular Weight |
378.428 g/mol |
SMILES |
N1C(NC(=C(C1C=1C(OCC2=CC=CC=C2)=CC=CC1)C(=O)OCC=C)C)=O |