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(4R)-4-Fluoro-4-tert-butyl-2-phenyl-4,5-dihydrobenzo[d]-1,3-oxazepine
SpectraBase Compound ID 6ZJBMJ5gOwT
InChI InChI=1S/C19H20FNO/c1-18(2,3)19(20)13-15-11-7-8-12-16(15)21-17(22-19)14-9-5-4-6-10-14/h4-12H,13H2,1-3H3/t19-/m0/s1
InChIKey ASRKCAUZTGHFOK-IBGZPJMESA-N
Mol Weight 297.37 g/mol
Molecular Formula C19H20FNO
Exact Mass 297.152892 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3JF4OORIps
Name (4R)-4-Fluoro-4-tert-butyl-2-phenyl-4,5-dihydrobenzo[d]-1,3-oxazepine
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20FNO
InChI InChI=1S/C19H20FNO/c1-18(2,3)19(20)13-15-11-7-8-12-16(15)21-17(22-19)14-9-5-4-6-10-14/h4-12H,13H2,1-3H3/t19-/m0/s1
InChIKey ASRKCAUZTGHFOK-IBGZPJMESA-N
Instrument Name Finnigan MAT SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.201504749
Molecular Weight 297.373 g/mol
Quality 205
Reported Formula C19H20FNO
SMILES C1=CC2=C(C=C1)N=C(O[C@](C2)(F)C(C)(C)C)C1=CC=CC=C1
SPLASH splash10-054o-1970000000-beca2f911864a739a8ff
Source of Spectrum QE-22-SM17-9r (DOI: 10.1002/chem.201504749)
Thin-Layer Chromatography 0.56 (hexane/EtOAc, 95:5)
Wiley ID 1903013