| SpectraBase Spectrum ID |
KCEoQTirMdm |
| Name |
3-Allyl-5-(4-methoxybenzoyl)-2-(methylthio)pyrimidin-4(3H)-one |
| Appearance |
Yellow crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H16N2O3S |
| InChI |
InChI=1S/C16H16N2O3S/c1-4-9-18-15(20)13(10-17-16(18)22-3)14(19)11-5-7-12(21-2)8-6-11/h4-8,10H,1,9H2,2-3H3 |
| InChIKey |
NVOAQPMZUPRYEQ-UHFFFAOYSA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.202000879 |
| Molecular Weight |
316.375 g/mol |
| SMILES |
C(N1C(SC)=NC=C(C(=O)c2ccc(cc2)OC)C1=O)C=C |
| SPLASH |
splash10-05n0-2975000000-036daa54c618ea72b7e0 |
| Source of Spectrum |
U1-2020-5535-6b |
| Wiley ID |
1860932 |
