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7,8-Dihydro-7-(4-methoxy-phenyl)-3-methyl-5-phenyl-6H-isoxazolo(4,5-B)azepine
SpectraBase Compound ID 9WJEnhT6Xpd
InChI InChI=1S/C21H20N2O2/c1-14-21-20(25-23-14)13-17(15-8-10-18(24-2)11-9-15)12-19(22-21)16-6-4-3-5-7-16/h3-11,17H,12-13H2,1-2H3
InChIKey MLUGSNXJOBFRCD-UHFFFAOYSA-N
Mol Weight 332.4 g/mol
Molecular Formula C21H20N2O2
Exact Mass 332.152478 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dz2dRmaH4Lx
Name 7,8-Dihydro-7-(4-methoxy-phenyl)-3-methyl-5-phenyl-6H-isoxazolo(4,5-B)azepine
CAS Registry Number 68257-84-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H20N2O2
InChI InChI=1S/C21H20N2O2/c1-14-21-20(25-23-14)13-17(15-8-10-18(24-2)11-9-15)12-19(22-21)16-6-4-3-5-7-16/h3-11,17H,12-13H2,1-2H3
InChIKey MLUGSNXJOBFRCD-UHFFFAOYSA-N
Instrument Name Varian FT-80
Literature Reference C.J. Rao, A.K. Murthy, J.N. Shoolery, Org. Magn. Resonance 21, 77 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3