| SpectraBase Spectrum ID |
H7ZMWxcGiI6 |
| Name |
5-Cyano-1,3-diallyl-6-phenyl-2-thiouracil |
| Comments |
Note: The molecular formula of the structure shown is C17H15N3OS - which differs from the formula reported for the mass spectrum (C18H17N3OS) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H17N3OS |
| InChI |
InChI=1S/C17H15N3OS/c1-3-10-19-15(13-8-6-5-7-9-13)14(12-18)16(21)20(11-4-2)17(19)22/h3-9H,1-2,10-11H2 |
| InChIKey |
FADYVNRYVDAFQV-UHFFFAOYSA-N |
| Molecular Weight |
309.387 g/mol |
| SMILES |
C(#N)C=1C(N(C(N(C1c1ccccc1)CC=C)=S)CC=C)=O |
| SPLASH |
splash10-00di-4119000000-a6f65c99eff1ea7302cf |
| Source of Spectrum |
H1-48-747-3 |
| Wiley ID |
816320 |
