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2,2-DICHLORO-2A-R-p-CHLOROPHENYL-2,2A,3A-C,4,5,6,7,7A-C-OCTAHYDRO-1H,4H-ACETO-[2,1-B]-[1,3]-BENZOXAZIN-1-ONE
SpectraBase Compound ID LUvqPrQqnbz
InChI InChI=1S/C16H16Cl3NO2/c17-12-7-5-11(6-8-12)16-15(18,19)14(21)20(16)9-10-3-1-2-4-13(10)22-16/h5-8,10,13H,1-4,9H2/t10-,13-,16+/m1/s1
InChIKey OOJBTSFDQOXIKW-ZXIHIIQKSA-N
Mol Weight 360.67 g/mol
Molecular Formula C16H16Cl3NO2
Exact Mass 359.024662 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CdS3305kj28
Name 2,2-DICHLORO-2A-R-p-CHLOROPHENYL-2,2A,3A-C,4,5,6,7,7A-C-OCTAHYDRO-1H,4H-ACETO-[2,1-B]-[1,3]-BENZOXAZIN-1-ONE
Compound Number 8
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C16H16Cl3NO2/c17-12-7-5-11(6-8-12)16-15(18,19)14(21)20(16)9-10-3-1-2-4-13(10)22-16/h5-8,10,13H,1-4,9H2/t10-,13-,16+/m1/s1
InChIKey OOJBTSFDQOXIKW-ZXIHIIQKSA-N
Literature Reference G.STAJER,A.E.SZABO,F.FUELOEP,G.BERNATH,P.SOHAR HETEROCYCLES,36,995(1993)
Solvent Chloroform-d
Technique SELECTIVE DECOUPLING; APT, DEPT, INEPT