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2-Benzylidene-4-phenylhexahydro-2H-benzo[b][1,4]oxazin-3(4H)-one
SpectraBase Compound ID KlBmF9Q5fz5
InChI InChI=1S/C21H21NO2/c23-21-20(15-16-9-3-1-4-10-16)24-19-14-8-7-13-18(19)22(21)17-11-5-2-6-12-17/h1-6,9-12,15,18-19H,7-8,13-14H2
InChIKey USLQIERIBFHNIT-UHFFFAOYSA-N
Mol Weight 319.4 g/mol
Molecular Formula C21H21NO2
Exact Mass 319.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1fDzW0XK1Kn
Name 2-Benzylidene-4-phenylhexahydro-2H-benzo[b][1,4]oxazin-3(4H)-one
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO2
InChI InChI=1S/C21H21NO2/c23-21-20(15-16-9-3-1-4-10-16)24-19-14-8-7-13-18(19)22(21)17-11-5-2-6-12-17/h1-6,9-12,15,18-19H,7-8,13-14H2
InChIKey USLQIERIBFHNIT-UHFFFAOYSA-N
Instrument Name Finnigan-MAT-8430
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3756
Molecular Weight 319.404 g/mol
SMILES C12N(C(C(OC2CCCC1)=Cc1ccccc1)=O)c1ccccc1
SPLASH splash10-004v-9320000000-5a5a0efcb0cef9c59a63
Source of Spectrum Y-57-147-4h
Thin-Layer Chromatography Rf = 0.41 (SiO2; Hexane/EtOAc, 6/1)
Wiley ID 1859703