| SpectraBase Spectrum ID |
BWzSstfkgtC |
| Name |
Ethyl 6-(benzo[d][1,3]dioxol-5-yl)-2-(3-chloro-2-hydroxypropylthio)-4-methyl-1,6-dihydropyrimidine-5-carboxylate |
| Appearance |
White crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H21ClN2O5S |
| InChI |
InChI=1S/C18H21ClN2O5S/c1-3-24-17(23)15-10(2)20-18(27-8-12(22)7-19)21-16(15)11-4-5-13-14(6-11)26-9-25-13/h4-6,12,16,22H,3,7-9H2,1-2H3,(H,20,21) |
| InChIKey |
CHCRFNYXBJPNAM-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMS-QP-1000EX |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.2358 |
| Molecular Weight |
412.888 g/mol |
| SMILES |
N1C(C(=C(N=C1SCC(CCl)O)C)C(OCC)=O)c1ccc2c(OCO2)c1 |
| SPLASH |
splash10-0560-3961000000-9e2d421d84091f4bb058 |
| Source of Spectrum |
Y-53-552-5 |
| Wiley ID |
1877649 |
![Ethyl 6-(benzo[d][1,3]dioxol-5-yl)-2-(3-chloro-2-hydroxypropylthio)-4-methyl-1,6-dihydropyrimidine-5-carboxylate](/api/spectrum/BWzSstfkgtC/structure.png?h=300&w=458 "Ethyl 6-(benzo[d][1,3]dioxol-5-yl)-2-(3-chloro-2-hydroxypropylthio)-4-methyl-1,6-dihydropyrimidine-5-carboxylate")
