| SpectraBase Spectrum ID |
LZSnyiFt9qF |
| Name |
5-Cyano-1,3-diethyl-6-phenyl-2-thiouracil |
| Comments |
Note: The molecular formula of the structure shown is C15H15N3OS - which differs from the formula reported for the mass spectrum (C17H15N3OS) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H15N3OS |
| InChI |
InChI=1S/C15H15N3OS/c1-3-17-13(11-8-6-5-7-9-11)12(10-16)14(19)18(4-2)15(17)20/h5-9H,3-4H2,1-2H3 |
| InChIKey |
QQHWUOWTWPPQLW-UHFFFAOYSA-N |
| Molecular Weight |
285.365 g/mol |
| SMILES |
C(#N)C=1C(N(C(N(C1c1ccccc1)CC)=S)CC)=O |
| SPLASH |
splash10-0690-7196000000-09f8bab6220adfe597e2 |
| Source of Spectrum |
H1-48-747-3 |
| Wiley ID |
816321 |
