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6-[(2'E)-3',7'-dimethyl-5'-oxo-2',6'-octadienyl]-5,7-dimethoxyphthalide
SpectraBase Compound ID 45T38CLSpRR
InChI InChI=1S/C20H24O5/c1-12(2)8-15(21)9-13(3)6-7-16-17(23-4)10-14-11-25-20(22)18(14)19(16)24-5/h6,8,10H,7,9,11H2,1-5H3/b13-6+
InChIKey ZUUPLBOAWLIESW-AWNIVKPZSA-N
Mol Weight 344.41 g/mol
Molecular Formula C20H24O5
Exact Mass 344.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzxCgjouEZE
Name 6-[(2'E)-3',7'-dimethyl-5'-oxo-2',6'-octadienyl]-5,7-dimethoxyphthalide
Alternate Name(s) 6-[(2E)-3,7-dimethyl-5-oxo-2,6-octadienyl]-5,7-dimethoxy-2-benzofuran-1(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24O5
InChI InChI=1S/C20H24O5/c1-12(2)8-15(21)9-13(3)6-7-16-17(23-4)10-14-11-25-20(22)18(14)19(16)24-5/h6,8,10H,7,9,11H2,1-5H3/b13-6+
InChIKey ZUUPLBOAWLIESW-AWNIVKPZSA-N
Molecular Weight 344.407 g/mol
SMILES c12c(c(C\C=C\(CC(C=C(C)C)=O)C)c(cc2COC1=O)OC)OC
SPLASH splash10-05o0-9000000000-c5ac18a222c087bc6c11
Source of Spectrum AT-31-376-3
Wiley ID 835731