| SpectraBase Spectrum ID |
10reuiSzav6 |
| Name |
(4S,5R)-4,5-Dimethyl-4-fluoro-2-phenyl-4,5-dihydrobenzo[d]-1,3-oxazepine |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
269.121592301 u |
| Formula |
C17H16FNO |
| InChI |
InChI=1S/C17H16FNO/c1-12-14-10-6-7-11-15(14)19-16(20-17(12,2)18)13-8-4-3-5-9-13/h3-12H,1-2H3/t12-,17-/m1/s1 |
| InChIKey |
FZHYSHFBXRXRMM-SJKOYZFVSA-N |
| Instrument Name |
Finnigan MAT SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201504749 |
| Molecular Weight |
269.319 g/mol |
| Quality |
171 |
| Reported Formula |
C17H16FNO |
| SMILES |
C1=CC2=C(C=C1)N=C(O[C@]([C@@]2(C)[H])(F)C)C1=CC=CC=C1 |
| SPLASH |
splash10-0a4i-1090000000-a2047b059a6348f95054 |
| Sample Comments |
dr = 80:20 |
| Source of Spectrum |
QE-22-SM18-9t (DOI: 10.1002/chem.201504749) |
| Thin-Layer Chromatography |
0.51 (hexane/EtOAc, 95:5) |
| Wiley ID |
1903014 |
![(4S,5R)-4,5-Dimethyl-4-fluoro-2-phenyl-4,5-dihydrobenzo[d]-1,3-oxazepine](/api/spectrum/10reuiSzav6/structure.png?h=300&w=458 "(4S,5R)-4,5-Dimethyl-4-fluoro-2-phenyl-4,5-dihydrobenzo[d]-1,3-oxazepine")
