| SpectraBase Spectrum ID |
FbWu6VIHiuF |
| Name |
4-Methyl-5-isobutyl-2-(2,2,2-trifluoroethylidene)-6-trifluoromethyl-2,3-dihydro-4H-1,4-oxazin-3-one |
| Comments |
Less than 3 mono-isotopic peaks; Note: The molecular formula of the structure shown is C12H13F6NO2 - which differs from the formula reported for the mass spectrum (C17H15F6NO2) |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H15F6NO2 |
| InChI |
InChI=1S/C12H13F6NO2/c1-6(2)4-7-9(12(16,17)18)21-8(5-11(13,14)15)10(20)19(7)3/h5-6H,4H2,1-3H3 |
| InChIKey |
NGHNQBSUOLMCLZ-UHFFFAOYSA-N |
| Molecular Weight |
317.231 g/mol |
| SMILES |
CN1C(C(OC(=C1CC(C)C)C(F)(F)F)=CC(F)(F)F)=O |
| SPLASH |
splash10-0006-9000000000-3218cbe4ee93eeb1d80e |
| Source of Spectrum |
H1-45-2189-2 |
| Wiley ID |
815910 |
