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(4S)-4-Fluoro-2-phenyl-4,7,9-trimethyl-4,5-dihydrobenzo[d]-1,3-oxazepine
SpectraBase Compound ID 1gvjsWwwQKy
InChI InChI=1S/C18H18FNO/c1-12-9-13(2)16-15(10-12)11-18(3,19)21-17(20-16)14-7-5-4-6-8-14/h4-10H,11H2,1-3H3/t18-/m1/s1
InChIKey FQTSWFJWDPGOKR-GOSISDBHSA-N
Mol Weight 283.35 g/mol
Molecular Formula C18H18FNO
Exact Mass 283.137242 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HCa55OnAC2u
Name (4S)-4-Fluoro-2-phenyl-4,7,9-trimethyl-4,5-dihydrobenzo[d]-1,3-oxazepine
Appearance Colorless solid
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Exact Mass 283.137242366 u
Formula C18H18FNO
InChI InChI=1S/C18H18FNO/c1-12-9-13(2)16-15(10-12)11-18(3,19)21-17(20-16)14-7-5-4-6-8-14/h4-10H,11H2,1-3H3/t18-/m1/s1
InChIKey FQTSWFJWDPGOKR-GOSISDBHSA-N
Instrument Name Finnigan MAT SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.201504749
Molecular Weight 283.346 g/mol
Quality 229
SMILES C1(=CC2=C(C(=C1)C)N=C(O[C@](C2)(F)C)C1=CC=CC=C1)C
SPLASH splash10-0c30-1390000000-6759cf356424bc151ab2
Source of Spectrum QE-22-SM12-9h (DOI: 10.1002/chem.201504749)
Thin-Layer Chromatography 0.53 (hexane/EtOAc, 95:5)
Wiley ID 1903003