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3-methoxy-4-[(2S,3R)-3-methyl-7-prop-1-ynyl-2,3-dihydro-1,4-benzodioxin-2-yl]pyrocatechol
SpectraBase Compound ID 9vPyfFJYGCC
InChI InChI=1S/C19H18O5/c1-4-5-12-6-9-15-16(10-12)24-18(11(2)23-15)13-7-8-14(20)17(21)19(13)22-3/h6-11,18,20-21H,1-3H3/t11-,18-/m1/s1
InChIKey ULNUXOQRWYVCCY-ADLMAVQZSA-N
Mol Weight 326.35 g/mol
Molecular Formula C19H18O5
Exact Mass 326.115424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4pUEPTFFMYe
Name 3-methoxy-4-[(2S,3R)-3-methyl-7-prop-1-ynyl-2,3-dihydro-1,4-benzodioxin-2-yl]pyrocatechol
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H18O5
InChI InChI=1S/C19H18O5/c1-4-5-12-6-9-15-16(10-12)24-18(11(2)23-15)13-7-8-14(20)17(21)19(13)22-3/h6-11,18,20-21H,1-3H3/t11-,18-/m1/s1
InChIKey ULNUXOQRWYVCCY-ADLMAVQZSA-N
Literature Reference Author Y.L.KIM,Y.W.CHIN,J.KIM
Literature Reference Citation CHEM.PHARM.BULL.,53,103(2005)
Literature Reference DOI 10.1248/cpb.53.103
Molecular Weight 326.349 g/mol
Sample ID 54714
Solvent CDCl3