{(6R)-6-[(6-Methyl-2-pyridinyl)oxy]-1,4-oxazepan-4-yl}[5-methyl-2-(trifluoromethyl)-3-furyl]methanone
11419
Reference
{(6R)-6-[(6-Methyl-2-pyridinyl)oxy]-1,4-oxazepan-4-yl}[5-methyl-2-(trifluoromethyl)-3-furyl]methanone Structure
Systematic / IUPAC Name: [(6R)-6-(6-Methylpyridin-2-yl)oxy-1,4-oxazepan-4-yl]-[5-methyl-2-(trifluoromethyl)furan-3-yl]methanone
ID: Reference11419
Other Names: NAT47-546933
Formula: C18H19F3N2O4
Spectral Data
{(6R)-6-[(6-Methyl-2-pyridinyl)oxy]-1,4-oxazepan-4-yl}[5-methyl-2-(trifluoromethyl)-3-furyl]methanone 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 | 1671 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 5/26/2022 8:14:58 AM |
Identificators
| InChI | InChI=1S/C18H19F3N2O4/c1-11-4-3-5-15(22-11)27-13-9-23(6-7-25-10-13)17(24)14-8-12(2)26-16(14)18(19,20)21/h3-5,8,13H,6-7,9-10H2,1-2H3/t13-/m1/s1 |
| InChI Key | QVHQYBUGFHELRR-CYBMUJFWSA-N |
| Canonical SMILES | CC1=NC(=CC=C1)OC2CN(CCOC2)C(=O)C3=C(OC(=C3)C)C(F)(F)F |
| CAS | |
| Splash | |
| Other Names | NAT47-546933 |