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(3S,4AR,8AS)-6,7-DIMETHYL-3-BENZYLOXY-4A,5,8,8A-TETRAHYDRO-1H-2-BENZOPYRAN-4(3H)-ONE
SpectraBase Compound ID 5WRtSPGQ4c6
InChI InChI=1S/C18H22O3/c1-12-8-15-11-21-18(17(19)16(15)9-13(12)2)20-10-14-6-4-3-5-7-14/h3-7,15-16,18H,8-11H2,1-2H3/t15-,16-,18-/m1/s1
InChIKey WOXHZENCBQDYPC-JFIYKMOQSA-N
Mol Weight 286.37 g/mol
Molecular Formula C18H22O3
Exact Mass 286.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ZFdrhY8x2A
Name (3S,4AR,8AS)-6,7-DIMETHYL-3-BENZYLOXY-4A,5,8,8A-TETRAHYDRO-1H-2-BENZOPYRAN-4(3H)-ONE
Compound Number 9A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22O3
InChI InChI=1S/C18H22O3/c1-12-8-15-11-21-18(17(19)16(15)9-13(12)2)20-10-14-6-4-3-5-7-14/h3-7,15-16,18H,8-11H2,1-2H3/t15-,16-,18-/m1/s1
InChIKey WOXHZENCBQDYPC-JFIYKMOQSA-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 286.371 g/mol
Solvent CDCl3
Source File Reference UWLU29139