(6R)-N-(2,4-Difluorophenyl)-6-{[5-(trifluoromethyl)-2-pyridinyl]oxy}-1,4-oxazepane-4-carboxamide
12691
Reference
(6R)-N-(2,4-Difluorophenyl)-6-{[5-(trifluoromethyl)-2-pyridinyl]oxy}-1,4-oxazepane-4-carboxamide Structure
Systematic / IUPAC Name: (6R)-N-(2,4-Difluorophenyl)-6-[5-(trifluoromethyl)pyridin-2-yl]oxy-1,4-oxazepane-4-carboxamide
ID: Reference12691
Other Names: NAT47-546981
Formula: C18H16F5N3O3
Spectral Data
(6R)-N-(2,4-Difluorophenyl)-6-{[5-(trifluoromethyl)-2-pyridinyl]oxy}-1,4-oxazepane-4-carboxamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
| No. of Spectral Trees | 1 |
| No. of Spectra | 739 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 7/31/2023 11:14:59 AM |
Identificators
| InChI | InChI=1S/C18H16F5N3O3/c19-12-2-3-15(14(20)7-12)25-17(27)26-5-6-28-10-13(9-26)29-16-4-1-11(8-24-16)18(21,22)23/h1-4,7-8,13H,5-6,9-10H2,(H,25,27)/t13-/m1/s1 |
| InChI Key | FBLDDFNRFDBMEF-CYBMUJFWSA-N |
| Canonical SMILES | C1COCC(CN1C(=O)NC2=C(C=C(C=C2)F)F)OC3=NC=C(C=C3)C(F)(F)F |
| CAS | |
| Splash | |
| Other Names | NAT47-546981 |