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TRANS-3-(3-PYRIDYL)-5A-METHYL-6-HYDROXY-1H,7H-5A,6,8,9-TETRAHYDRO-1-OXOPYRANO-[4.3-B]-[1]-BENZOPYRAN
SpectraBase Compound ID FwTonbYnYsA
InChI InChI=1S/C18H17NO4/c1-18-12(5-2-6-16(18)20)8-13-15(23-18)9-14(22-17(13)21)11-4-3-7-19-10-11/h3-4,7-10,16,20H,2,5-6H2,1H3/t16-,18+/m1/s1
InChIKey DYGLSIGDCZTHCV-AEFFLSMTSA-N
Mol Weight 311.34 g/mol
Molecular Formula C18H17NO4
Exact Mass 311.115758 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cui7CFlEHRz
Name TRANS-3-(3-PYRIDYL)-5A-METHYL-6-HYDROXY-1H,7H-5A,6,8,9-TETRAHYDRO-1-OXOPYRANO-[4.3-B]-[1]-BENZOPYRAN
Compound Number 27B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H17NO4
InChI InChI=1S/C18H17NO4/c1-18-12(5-2-6-16(18)20)8-13-15(23-18)9-14(22-17(13)21)11-4-3-7-19-10-11/h3-4,7-10,16,20H,2,5-6H2,1H3/t16-,18+/m1/s1
InChIKey DYGLSIGDCZTHCV-AEFFLSMTSA-N
Literature Reference Author D.H.HUA,Y.CHEN,H.S.SIN,M.J.MARORO,P.D.ROBINSON,S.W.NEWELL,E. M.PERCHELLET,J.B.LAD
Literature Reference Citation J.ORG.CHEM.,62,6888(1997)
Literature Reference DOI 10.1021/jo970642d
Molecular Weight 311.337 g/mol
Solvent CDCl3
Source File Reference UWMZ4423