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TRANS-4-(2-CHLOROBENZOYL)-2-METHYL-PERHYDRO-1,4-OXAZEPIN-3-ONE
SpectraBase Compound ID c613IWlgu4
InChI InChI=1S/C17H20ClNO3/c1-11-16(20)19(10-12-6-2-5-9-15(12)22-11)17(21)13-7-3-4-8-14(13)18/h3-4,7-8,11-12,15H,2,5-6,9-10H2,1H3/t11?,12-,15+/m0/s1
InChIKey ZFABPKBFDUIYBI-WQKBPTQTSA-N
Mol Weight 321.8 g/mol
Molecular Formula C17H20ClNO3
Exact Mass 321.113171 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K0EwY8mlNL4
Name TRANS-4-(2-CHLOROBENZOYL)-2-METHYL-PERHYDRO-1,4-OXAZEPIN-3-ONE
Compound Number 6D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H20ClNO3
InChI InChI=1S/C17H20ClNO3/c1-11-16(20)19(10-12-6-2-5-9-15(12)22-11)17(21)13-7-3-4-8-14(13)18/h3-4,7-8,11-12,15H,2,5-6,9-10H2,1H3/t11?,12-,15+/m0/s1
InChIKey ZFABPKBFDUIYBI-WQKBPTQTSA-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 321.804 g/mol
Solvent CDCl3
Source File Reference UWCS20934