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Wortmin
SpectraBase Compound ID 6T2oEStqwiK
InChI InChI=1S/C24H28O8/c1-6-7-16-9-15-10-20(31-14(3)25)24(4,22(27)18(15)12-30-16)32-23(28)21-13(2)8-17(29-5)11-19(21)26/h6-8,11,16,20,26H,9-10,12H2,1-5H3
InChIKey AVHDFUVJYKFWOO-UHFFFAOYSA-N
Mol Weight 444.48 g/mol
Molecular Formula C24H28O8
Exact Mass 444.178418 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FS2EoIJGaGV
Name Wortmin
Alternate Name(s) 6-Acetoxy-7-methyl-8-oxo-3-(prop-1-en-1-yl)-3,4,5,6,7,8-hexahydro-1H-isochromen-7-yl 2-hydroxy-4-methoxy-6-methylbenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H28O8
InChI InChI=1S/C24H28O8/c1-6-7-16-9-15-10-20(31-14(3)25)24(4,22(27)18(15)12-30-16)32-23(28)21-13(2)8-17(29-5)11-19(21)26/h6-8,11,16,20,26H,9-10,12H2,1-5H3
InChIKey AVHDFUVJYKFWOO-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.19730560113
Molecular Weight 444.480 g/mol
SMILES Oc1cc(cc(c1C(OC1(C(CC2=C(C1=O)COC(C2)C=CC)OC(C)=O)C)=O)C)OC
SPLASH splash10-0pvu-1910000000-28f0a4d26cafcf97c2d5
Source of Spectrum H-56-238-1
Wiley ID 1797064