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(3AS,5S,6S,7R,7AS)-OCTAHYDRO-5-HYDRO-6,7,ISOPROPYLIDENE-DIOXY-1-METHYL-2,1-BENZISOXYZOLE
SpectraBase Compound ID KgRRAbKZyBf
InChI InChI=1S/C11H19NO4/c1-11(2)15-9-7(13)4-6-5-14-12(3)8(6)10(9)16-11/h6-10,13H,4-5H2,1-3H3/t6-,7?,8+,9?,10?/m1/s1
InChIKey JMACWHQFWKFNGE-AXUDDMIQSA-N
Mol Weight 229.28 g/mol
Molecular Formula C11H19NO4
Exact Mass 229.131408 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7bhRddpKDtL
Name (3AS,5S,6S,7R,7AS)-OCTAHYDRO-5-HYDRO-6,7,ISOPROPYLIDENE-DIOXY-1-METHYL-2,1-BENZISOXYZOLE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H19NO4
InChI InChI=1S/C11H19NO4/c1-11(2)15-9-7(13)4-6-5-14-12(3)8(6)10(9)16-11/h6-10,13H,4-5H2,1-3H3/t6-,7?,8+,9?,10?/m1/s1
InChIKey JMACWHQFWKFNGE-AXUDDMIQSA-N
Literature Reference Author S.JIANG,K.J.MCCULLOUGH,B.MEKKI,G.SINGH,R.H.WIGHTMAN
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1805(1997)
Literature Reference DOI 10.1039/a700389g
Molecular Weight 229.276 g/mol
Solvent CDCl3
Source File Reference UWBS1262