| SpectraBase Spectrum ID |
8n6pXotO6pc |
| Name |
1-(Cyclohexylcarbamoyl)cyclopentyl 2-([4-oxo-6-propyl-1,4-dihydropyrimidin-2-yl]thio)acetate |
| Appearance |
White powder |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H31N3O4S |
| InChI |
InChI=1S/C21H31N3O4S/c1-2-8-16-13-17(25)24-20(23-16)29-14-18(26)28-21(11-6-7-12-21)19(27)22-15-9-4-3-5-10-15/h13,15H,2-12,14H2,1H3,(H,22,27)(H,23,24,25) |
| InChIKey |
VKRSCAPASCXJGQ-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT-8430 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jccs.201800209 |
| Molecular Weight |
421.556 g/mol |
| SMILES |
N1C(SCC(OC2(C(=O)NC3CCCCC3)CCCC2)=O)=NC(=O)C=C1CCC |
| SPLASH |
splash10-06si-9560000000-916e4d37881f9f10330a |
| Source of Spectrum |
QA-66-1378-5c |
| Wiley ID |
1838597 |
![1-(Cyclohexylcarbamoyl)cyclopentyl 2-([4-oxo-6-propyl-1,4-dihydropyrimidin-2-yl]thio)acetate](/api/spectrum/8n6pXotO6pc/structure.png?h=300&w=458 "1-(Cyclohexylcarbamoyl)cyclopentyl 2-([4-oxo-6-propyl-1,4-dihydropyrimidin-2-yl]thio)acetate")
