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4-ACETYL-8-HYDROXY-6-METHOXY-5-METHYLISOCOUMARIN
SpectraBase Compound ID BPNyjYhv7rN
InChI InChI=1S/C13H14O5/c1-6-10(17-3)4-9(15)12-11(6)8(7(2)14)5-18-13(12)16/h4,8,15H,5H2,1-3H3
InChIKey WDZKVEWQIUSSSX-UHFFFAOYSA-N
Mol Weight 250.25 g/mol
Molecular Formula C13H14O5
Exact Mass 250.084124 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID nGSDfDOAWJ
Name 4-ACETYL-8-HYDROXY-6-METHOXY-5-METHYLISOCOUMARIN
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H14O5
InChI InChI=1S/C13H14O5/c1-6-10(17-3)4-9(15)12-11(6)8(7(2)14)5-18-13(12)16/h4,8,15H,5H2,1-3H3
InChIKey WDZKVEWQIUSSSX-UHFFFAOYSA-N
Literature Reference Author A.C.WHYTE,J.B.GLOER,J.A.SCOTT,D.MALLOCH
Literature Reference Citation J.NAT.PROD.,59,765(1996)
Literature Reference DOI 10.1021/np9603232
Molecular Weight 250.251 g/mol
Solvent CDCl3
Source File Reference UWVP775