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4A,1-(TRANS)-8-METHOXY-6-METHYL-2,3,4,4A,9,9A-HEXAHYDRO-1H-XANTHENE-1-OL;CIS-ISOMER
SpectraBase Compound ID 6F3Q5FK6ymZ
InChI InChI=1S/C15H20O3/c1-9-6-14(17-2)11-8-10-12(16)4-3-5-13(10)18-15(11)7-9/h6-7,10,12-13,16H,3-5,8H2,1-2H3/t10-,12+,13-/m1/s1
InChIKey NVGQYJZGOBDDAG-KGYLQXTDSA-N
Mol Weight 248.32 g/mol
Molecular Formula C15H20O3
Exact Mass 248.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C1ZnfGQfMcm
Name 4A,1-(TRANS)-8-METHOXY-6-METHYL-2,3,4,4A,9,9A-HEXAHYDRO-1H-XANTHENE-1-OL;CIS-ISOMER
Compound Number 100
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H20O3
InChI InChI=1S/C15H20O3/c1-9-6-14(17-2)11-8-10-12(16)4-3-5-13(10)18-15(11)7-9/h6-7,10,12-13,16H,3-5,8H2,1-2H3/t10-,12+,13-/m1/s1
InChIKey NVGQYJZGOBDDAG-KGYLQXTDSA-N
Literature Reference Author A.C.MEISTER,A.ENCINAS,H.SAHIN,E.M.C.SINGER,C.F.NISING,M.NIEG ER,S.BRAESE
Literature Reference Citation EUR.J.ORG.CHEM.,2014,4861(2014)
Literature Reference DOI 10.1002/ejoc.201402083
Molecular Weight 248.322 g/mol
Solvent CDCl3
Source File Reference UWIR19925