SpectraBase Spectrum ID |
K02DtCxWC6V |
Name |
Methyl 1,2,3,4-tetrahydro-6-methyl-2,4-bis(2'-(trifluoromethyl)phenyl]pyrimidine-5-carboxylate |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H18F6N2O2 |
InChI |
InChI=1S/C21H18F6N2O2/c1-11-16(19(30)31-2)17(12-7-3-5-9-14(12)20(22,23)24)29-18(28-11)13-8-4-6-10-15(13)21(25,26)27/h3-10,17-18,28-29H,1-2H3 |
InChIKey |
KFFYCGPKXDCVIE-UHFFFAOYSA-N |
Molecular Weight |
444.377 g/mol |
SMILES |
N1C(NC(=C(C1c1c(C(F)(F)F)cccc1)C(=O)OC)C)c1c(C(F)(F)F)cccc1 |
SPLASH |
splash10-00di-0090100000-b9753f75e3122c04fe74 |
Source of Spectrum |
D8-324-795-16 |
Synonyms |
methyl 6-methyl-2,4-bis[2-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate |
Wiley ID |
1514143 |