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OMPHAMURRAYIN;5,7-DIMETHOXY-8-(1-OXO-2-SENECIOYL-3-METHYL-3-BUTENYL)-2H-1-BENZOPYRAN-2-ONE
SpectraBase Compound ID ERag5yVLhhI
InChI InChI=1S/C21H22O7/c1-11(2)9-17(23)28-20(12(3)4)19(24)18-15(26-6)10-14(25-5)13-7-8-16(22)27-21(13)18/h7-10,20H,3H2,1-2,4-6H3
InChIKey DHOIEDGWWICFBO-UHFFFAOYSA-N
Mol Weight 386.4 g/mol
Molecular Formula C21H22O7
Exact Mass 386.136553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID dkGyzAqr1j
Name Omphamurrayin [5,7-dimethoxy-8-(1-oxo-2-senecioyl-3-methyl-3-butenyl)-2H-benzopyran-2-one]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22O7
InChI InChI=1S/C21H22O7/c1-11(2)9-17(23)28-20(12(3)4)19(24)18-15(26-6)10-14(25-5)13-7-8-16(22)27-21(13)18/h7-10,20H,3H2,1-2,4-6H3
InChIKey DHOIEDGWWICFBO-UHFFFAOYSA-N
Molecular Weight 386.400 g/mol
SMILES c1(c2c(C=CC(O2)=O)c(cc1OC)OC)C(C(OC(C=C(C)C)=O)C(=C)C)=O
SPLASH splash10-001i-1090000000-134636d18d48ced97f49
Source of Spectrum E2-50-119-1
Synonyms 3-Methyl-2-butenoic acid [1-(5,7-dimethoxy-2-oxo-1-benzopyran-8-yl)-3-methyl-1-oxobut-3-en-2-yl] ester [1-(5,7-dimethoxy-2-oxochromen-8-yl)-3-methyl-1-oxobut-3-en-2-yl] 3-methylbut-2-enoate [1-(5,7-dimethoxy-2-oxo-chromene-8-carbonyl)-2-methyl-allyl] 3-methylbut-2-enoate [1-(5,7-dimethoxy-2-oxidanylidene-chromen-8-yl)-3-methyl-1-oxidanylidene-but-3-en-2-yl] 3-methylbut-2-enoate
Wiley ID 1555808