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(3R,4AR,8AS)-6,7-DIMETHYL-3-METHOXY-4A,5,8,8A-TETRAHYDRO-1H-2-BENZOPYRAN-4(3H)-ONE
SpectraBase Compound ID IRbAOJLrAjj
InChI InChI=1S/C12H18O3/c1-7-4-9-6-15-12(14-3)11(13)10(9)5-8(7)2/h9-10,12H,4-6H2,1-3H3/t9-,10-,12-/m1/s1
InChIKey SUDNNGAVRPJGQX-CKYFFXLPSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HSxfWkZNFbK
Name (3R,4AR,8AS)-6,7-DIMETHYL-3-METHOXY-4A,5,8,8A-TETRAHYDRO-1H-2-BENZOPYRAN-4(3H)-ONE
Compound Number 9B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-7-4-9-6-15-12(14-3)11(13)10(9)5-8(7)2/h9-10,12H,4-6H2,1-3H3/t9-,10-,12-/m1/s1
InChIKey SUDNNGAVRPJGQX-CKYFFXLPSA-N
Literature Reference Author C.A.I.CAPACCIO,O.VARELA
Literature Reference Citation J.ORG.CHEM.,66,8859(2001)
Literature Reference DOI 10.1021/jo0106896
Molecular Weight 210.273 g/mol
Solvent CDCl3
Source File Reference UWLU29140