| SpectraBase Spectrum ID |
5aw5fDYU1ie |
| Name |
(4S)-7-Chloro-4-fluoro-4-methyl-2-phenyl-4,5-dihydrobenzo[d]-1,3-oxazepine |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
289.066969905 u |
| Formula |
C16H13ClFNO |
| InChI |
InChI=1S/C16H13ClFNO/c1-16(18)10-12-9-13(17)7-8-14(12)19-15(20-16)11-5-3-2-4-6-11/h2-9H,10H2,1H3/t16-/m1/s1 |
| InChIKey |
UTOXDCVRYLMRQV-MRXNPFEDSA-N |
| Instrument Name |
Finnigan MAT SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201504749 |
| Molecular Weight |
289.737 g/mol |
| Quality |
319 |
| Reported Formula |
C16H13ClFNO |
| SMILES |
C1(=CC2=C(C=C1)N=C(O[C@](C2)(F)C)C1=CC=CC=C1)Cl |
| SPLASH |
splash10-004j-0290000000-6c5d08aa6d09375145da |
| Source of Spectrum |
QE-22-SM13-9k (DOI: 10.1002/chem.201504749) |
| Thin-Layer Chromatography |
0.51 (hexane/EtOAc, 95:5) |
| Wiley ID |
1903006 |
![(4S)-7-Chloro-4-fluoro-4-methyl-2-phenyl-4,5-dihydrobenzo[d]-1,3-oxazepine](/api/spectrum/5aw5fDYU1ie/structure.png?h=300&w=458 "(4S)-7-Chloro-4-fluoro-4-methyl-2-phenyl-4,5-dihydrobenzo[d]-1,3-oxazepine")
