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ETHYL-(3AR*,4R*,7R*,7AR*)-7-IODO-2-METHYL-3A,4,5,6,7,7A-HEXAHYDROBENZOXAZOLE-4-CARBOXYLATE
SpectraBase Compound ID BF67682l2ll
InChI InChI=1S/C11H16INO3/c1-3-15-11(14)7-4-5-8(12)10-9(7)13-6(2)16-10/h7-10H,3-5H2,1-2H3/t7-,8-,9-,10+/m1/s1
InChIKey ICBYDMWGCKLQIS-KYXWUPHJSA-N
Mol Weight 337.16 g/mol
Molecular Formula C11H16INO3
Exact Mass 337.017488 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5nClAMFTYU4
Name ETHYL-(3AR*,4R*,7R*,7AR*)-7-IODO-2-METHYL-3A,4,5,6,7,7A-HEXAHYDROBENZOXAZOLE-4-CARBOXYLATE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H16INO3
InChI InChI=1S/C11H16INO3/c1-3-15-11(14)7-4-5-8(12)10-9(7)13-6(2)16-10/h7-10H,3-5H2,1-2H3/t7-,8-,9-,10+/m1/s1
InChIKey ICBYDMWGCKLQIS-KYXWUPHJSA-N
Literature Reference Author Z.SZAKONYI,S.GYONFALVI,E.FORRO,A.HETENYI,N.D.KIMPE,F.FUELOEP
Literature Reference Citation EUR.J.ORG.CHEM.,4017(2005)
Molecular Weight 337.157 g/mol
Sample ID 30486
Solvent CDCl3