| SpectraBase Spectrum ID |
EpP5hkJ9P4L |
| Name |
Trans-1-(dimethylamino)-4-[(alpha,alpha,alpha-trifluoro-m-tolyl)oxy]-1-penten-3-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
287.113313246 u |
| Formula |
C14H16F3NO2 |
| InChI |
InChI=1S/C14H16F3NO2/c1-10(13(19)7-8-18(2)3)20-12-6-4-5-11(9-12)14(15,16)17/h4-10H,1-3H3/b8-7+ |
| InChIKey |
WHSWXENYXJYIPH-BQYQJAHWSA-N |
| Molecular Weight |
287.282 g/mol |
| SMILES |
C(F)(C=1C=CC=C(OC(C)C(\C=C\N(C)C)=O)C1)(F)F |
| Spectrum/Structure Validation Score (Raman) |
0.947255 |
![Trans-1-(dimethylamino)-4-[(alpha,alpha,alpha-trifluoro-m-tolyl)oxy]-1-penten-3-one](/api/spectrum/EpP5hkJ9P4L/structure.png?h=300&w=458 "Trans-1-(dimethylamino)-4-[(alpha,alpha,alpha-trifluoro-m-tolyl)oxy]-1-penten-3-one")
