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(REL)-(4S,4AR,8AR)-3-(IODOMETHYL)-4-(4-METHOXYPHENYL)-4A,5,6,7,8,8A-HEXAHYDRO-4H-1,2-BENZOXAZINE
SpectraBase Compound ID T8IPTmsrGg
InChI InChI=1S/C16H20INO2/c1-19-12-8-6-11(7-9-12)16-13-4-2-3-5-15(13)20-18-14(16)10-17/h6-9,13,15-16H,2-5,10H2,1H3/t13-,15+,16+/m0/s1
InChIKey WVLZMVDYFDSEPN-NUEKZKHPSA-N
Mol Weight 385.25 g/mol
Molecular Formula C16H20INO2
Exact Mass 385.053874 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FAZjbgjZkgF
Name (REL)-(4S,4AR,8AR)-3-(IODOMETHYL)-4-(4-METHOXYPHENYL)-4A,5,6,7,8,8A-HEXAHYDRO-4H-1,2-BENZOXAZINE
Compound Number 1S
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H20INO2
InChI InChI=1S/C16H20INO2/c1-19-12-8-6-11(7-9-12)16-13-4-2-3-5-15(13)20-18-14(16)10-17/h6-9,13,15-16H,2-5,10H2,1H3/t13-,15+,16+/m0/s1
InChIKey WVLZMVDYFDSEPN-NUEKZKHPSA-N
Literature Reference Author A.Y.SUKHORUKOV,M.A.KAPATSYNA,T.L.T.YI,H.R.PARK,Y.A.NAUMOVICH ,P.A.ZHMUROV
Literature Reference Citation EUR.J.ORG.CHEM.,2014,8148(2014)
Literature Reference DOI 10.1002/ejoc.201403083
Molecular Weight 385.245 g/mol
Solvent CDCl3
Source File Reference UWIR20267