| SpectraBase Spectrum ID |
5ovSKUSoVs9 |
| Name |
1-(2-(4-Acetylphenyl)-3,3,3-trifluoropropyl)-5-bromopyridin-2(1H)-one |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
387.008176150 u |
| Formula |
C16H13BrF3NO2 |
| InChI |
InChI=1S/C16H13BrF3NO2/c1-10(22)11-2-4-12(5-3-11)14(16(18,19)20)9-21-8-13(17)6-7-15(21)23/h2-8,14H,9H2,1H3 |
| InChIKey |
CVKNNWKCIGNEKJ-UHFFFAOYSA-N |
| Instrument Name |
Waters GCT Premier |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.1002/asia.202300144 |
| Molecular Weight |
388.184 g/mol |
| Quality |
970 |
| Reported Formula |
C16H13BrF3NO2 |
| SMILES |
C(CN1C=C(C=CC1=O)Br)(C1=CC=C(C=C1)C(=O)C)C(F)(F)F |
| SPLASH |
splash10-00bi-1901000000-7ef6a75726e602974f30 |
| Source of Spectrum |
CAJ-18-SM67-3he (DOI: 10.1002/asia.202300144) |
| Wiley ID |
1909835 |
