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2-R-CHLORO-2A-C-p-CHLOROPHENYL-2,2A,3A-C,4,5,6,7,7A-T-OCTAHYDRO-1H,4H-ACETO-[2,1-B]-[1,3]-BENZOXAZIN-1-ONE

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2-R-CHLORO-2A-C-p-CHLOROPHENYL-2,2A,3A-C,4,5,6,7,7A-T-OCTAHYDRO-1H,4H-ACETO-[2,1-B]-[1,3]-BENZOXAZIN-1-ONE
SpectraBase Compound ID GQ62usy8kKx
InChI InChI=1S/C16H17Cl2NO2/c17-12-7-5-11(6-8-12)16-14(18)15(20)19(16)9-10-3-1-2-4-13(10)21-16/h5-8,10,13-14H,1-4,9H2/t10-,13+,14-,16+/m0/s1
InChIKey VXJYUONAXVWOJH-HPGNRBDVSA-N
Mol Weight 326.22 g/mol
Molecular Formula C16H17Cl2NO2
Exact Mass 325.063634 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E0am3HuTHBo
Name 2-R-CHLORO-2A-C-p-CHLOROPHENYL-2,2A,3A-C,4,5,6,7,7A-T-OCTAHYDRO-1H,4H-ACETO-[2,1-B]-[1,3]-BENZOXAZIN-1-ONE
Compound Number 9A
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C16H17Cl2NO2/c17-12-7-5-11(6-8-12)16-14(18)15(20)19(16)9-10-3-1-2-4-13(10)21-16/h5-8,10,13-14H,1-4,9H2/t10-,13+,14-,16+/m0/s1
InChIKey VXJYUONAXVWOJH-HPGNRBDVSA-N
Literature Reference G.STAJER,A.E.SZABO,F.FUELOEP,G.BERNATH,P.SOHAR HETEROCYCLES,36,995(1993)
Solvent Dimethyl sulfoxide-d6
Technique SELECTIVE DECOUPLING; APT, DEPT, INEPT