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2,4,5,7,8-PENTAMETHYL-4H-1,3-BENZODIOXIN-6-OL;CIS-ISOMER;3-OXA-2,4,5,7,8-PENTAMETHYL-4H-1,3-BENZODIOXIN-6-OL
SpectraBase Compound ID DWi14j49H7L
InChI InChI=1S/C13H18O3/c1-6-7(2)13-11(8(3)12(6)14)9(4)15-10(5)16-13/h9-10,14H,1-5H3/t9-,10-/m0/s1
InChIKey CEEFMWMCLOFOPY-UWVGGRQHSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kh46K8s6MSk
Name 2,4,5,7,8-PENTAMETHYL-4H-1,3-BENZODIOXIN-6-OL;CIS-ISOMER;3-OXA-2,4,5,7,8-PENTAMETHYL-4H-1,3-BENZODIOXIN-6-OL
Compound Number 1B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-6-7(2)13-11(8(3)12(6)14)9(4)15-10(5)16-13/h9-10,14H,1-5H3/t9-,10-/m0/s1
InChIKey CEEFMWMCLOFOPY-UWVGGRQHSA-N
Literature Reference Author T.ROSENAU,A.POTTHAST,T.ELDER,T.LANGE,H.SIXTA,P.KOSMA
Literature Reference Citation J.ORG.CHEM.,67,3607(2002)
Literature Reference DOI 10.1021/jo016125j
Molecular Weight 222.284 g/mol
Solvent CDCl3
Source File Reference UWSI21748