| SpectraBase Spectrum ID |
JKHMPR1Dbgs |
| Name |
Thiourea, N-[3,5-bis(trifluoromethyl)phenyl]-N'-(2-propenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
328.046888482 u |
| Formula |
C12H10F6N2S |
| InChI |
InChI=1S/C12H10F6N2S/c1-2-3-19-10(21)20-9-5-7(11(13,14)15)4-8(6-9)12(16,17)18/h2,4-6H,1,3H2,(H2,19,20,21) |
| InChIKey |
GASTZCPNGDNQDL-UHFFFAOYSA-N |
| Molecular Weight |
328.276 g/mol |
| SMILES |
C(=S)(NC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)NCC=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.923938 |
![Thiourea, N-[3,5-bis(trifluoromethyl)phenyl]-N'-(2-propenyl)-](/api/spectrum/JKHMPR1Dbgs/structure.png?h=300&w=458 "Thiourea, N-[3,5-bis(trifluoromethyl)phenyl]-N'-(2-propenyl)-")
