| SpectraBase Spectrum ID |
GKtlmWl27d7 |
| Name |
1-(2-(4-Acetylphenyl)-3,3,3-trifluoropropyl)-5-nitropyridin-2(1H)-one |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
354.082741392 u |
| Formula |
C16H13F3N2O4 |
| InChI |
InChI=1S/C16H13F3N2O4/c1-10(22)11-2-4-12(5-3-11)14(16(17,18)19)9-20-8-13(21(24)25)6-7-15(20)23/h2-8,14H,9H2,1H3 |
| InChIKey |
WVKPLTJMBARUKL-UHFFFAOYSA-N |
| Instrument Name |
Waters GCT Premier |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.1002/asia.202300144 |
| Molecular Weight |
354.285 g/mol |
| Quality |
903 |
| Reported Formula |
C16H13F3N2O4 |
| SMILES |
C(CN1C=C(C=CC1=O)[N+]([O-])=O)(C1=CC=C(C=C1)C(=O)C)C(F)(F)F |
| SPLASH |
splash10-0002-1931000000-79e77bb16e811a294a23 |
| Source of Spectrum |
CAJ-18-SM73-3hh (DOI: 10.1002/asia.202300144) |
| Wiley ID |
1909837 |
