John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=6x36rE8C76x SpectraBase Spectrum ID=1IdtEPgYpVf

(accessed ).
TRANS-4-BENZOYL-2-METHYL-PERHYDRO-1,4-OXAZEPIN-3-ONE
SpectraBase Compound ID 6x36rE8C76x
InChI InChI=1S/C17H21NO3/c1-12-16(19)18(17(20)13-7-3-2-4-8-13)11-14-9-5-6-10-15(14)21-12/h2-4,7-8,12,14-15H,5-6,9-11H2,1H3/t12?,14-,15+/m0/s1
InChIKey DRAUVNCHJZOQNR-JQXSQYPDSA-N
Mol Weight 287.36 g/mol
Molecular Formula C17H21NO3
Exact Mass 287.152144 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1IdtEPgYpVf
Name TRANS-4-BENZOYL-2-METHYL-PERHYDRO-1,4-OXAZEPIN-3-ONE
Compound Number 6B
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H21NO3
InChI InChI=1S/C17H21NO3/c1-12-16(19)18(17(20)13-7-3-2-4-8-13)11-14-9-5-6-10-15(14)21-12/h2-4,7-8,12,14-15H,5-6,9-11H2,1H3/t12?,14-,15+/m0/s1
InChIKey DRAUVNCHJZOQNR-JQXSQYPDSA-N
Literature Reference Author L.SIMON,S.G.TALPAS,F.FUELOEP,G.BERNATH,G.ARGAY,A.KALMAN,P.SO HAR
Literature Reference Citation J.HETCYCL.CHEM.,32,161(1995)
Literature Reference DOI 10.1002/jhet.5570320126
Molecular Weight 287.359 g/mol
Solvent CDCl3
Source File Reference UWCS20932
SpectraBase Batch ID GUOHieDSLFa