(6R)-N-Propyl-6-{[5-(trifluoromethyl)-2-pyridinyl]oxy}-1,4-oxazepane-4-carboxamide
12842
Reference
(6R)-N-Propyl-6-{[5-(trifluoromethyl)-2-pyridinyl]oxy}-1,4-oxazepane-4-carboxamide Structure
Systematic / IUPAC Name: (6R)-N-Propyl-6-[5-(trifluoromethyl)pyridin-2-yl]oxy-1,4-oxazepane-4-carboxamide
ID: Reference12842
Other Names: NAT47-546992
Formula: C15H20F3N3O3
Spectral Data
(6R)-N-Propyl-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 | 545 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 10/27/2023 7:36:21 AM |
Identificators
| InChI | InChI=1S/C15H20F3N3O3/c1-2-5-19-14(22)21-6-7-23-10-12(9-21)24-13-4-3-11(8-20-13)15(16,17)18/h3-4,8,12H,2,5-7,9-10H2,1H3,(H,19,22)/t12-/m1/s1 |
| InChI Key | VCNKFQMHVKGFIQ-GFCCVEGCSA-N |
| Canonical SMILES | CCCNC(=O)N1CCOCC(C1)OC2=NC=C(C=C2)C(F)(F)F |
| CAS | |
| Splash | |
| Other Names | NAT47-546992 |