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TRANS-3-(3,4-DIMETHOXYPHENYL)-6-(FORMYLOXY)-5A-METHYL-1H,7H-5A,6,8,9-TETRAHYDRO-1-OXOPYRANO-[4.3-B]-[1]-BENZOPYRAN
SpectraBase Compound ID K9VaFF4A3Rh
InChI InChI=1S/C22H22O7/c1-22-14(5-4-6-20(22)27-12-23)10-15-18(29-22)11-17(28-21(15)24)13-7-8-16(25-2)19(9-13)26-3/h7-12,20H,4-6H2,1-3H3/t20-,22+/m1/s1
InChIKey MJCFYSFNOHBQKK-IRLDBZIGSA-N
Mol Weight 398.41 g/mol
Molecular Formula C22H22O7
Exact Mass 398.136553 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ETuuBx8tBaC
Name TRANS-3-(3,4-DIMETHOXYPHENYL)-6-(FORMYLOXY)-5A-METHYL-1H,7H-5A,6,8,9-TETRAHYDRO-1-OXOPYRANO-[4.3-B]-[1]-BENZOPYRAN
Compound Number 28B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22O7
InChI InChI=1S/C22H22O7/c1-22-14(5-4-6-20(22)27-12-23)10-15-18(29-22)11-17(28-21(15)24)13-7-8-16(25-2)19(9-13)26-3/h7-12,20H,4-6H2,1-3H3/t20-,22+/m1/s1
InChIKey MJCFYSFNOHBQKK-IRLDBZIGSA-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 398.412 g/mol
Solvent CDCl3
Source File Reference UWMZ4425