Systematic / IUPAC Name: [(6R)-6-Pyrazin-2-yloxy-1,4-oxazepan-4-yl]-[4-(trifluoromethyl)phenyl]methanone
ID: Reference11385
Other Names: NAT47-552332
Formula: C17H16F3N3O3
[(6R)-6-(2-Pyrazinyloxy)-1,4-oxazepan-4-yl][4-(trifluoromethyl)phenyl]methanone mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
No. of Spectral Trees | 1 |
No. of Spectra | 910 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 5/5/2022 2:32:08 PM |
InChI | InChI=1S/C17H16F3N3O3/c18-17(19,20)13-3-1-12(2-4-13)16(24)23-7-8-25-11-14(10-23)26-15-9-21-5-6-22-15/h1-6,9,14H,7-8,10-11H2/t14-/m1/s1 |
InChI Key | MEEHWPYQKSAIMR-CQSZACIVSA-N |
Canonical SMILES | C1COCC(CN1C(=O)C2=CC=C(C=C2)C(F)(F)F)OC3=NC=CN=C3 |
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Other Names | NAT47-552332 |