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5,7-DIMETHOXY-8-(1-OXO-3-METHYL-3-BUTENYL)-2H-1-BENZOPYRAN-2-ONE
SpectraBase Compound ID CP363i1OiWM
InChI InChI=1S/C16H16O6/c1-8(2)14(18)15(19)13-11(21-4)7-10(20-3)9-5-6-12(17)22-16(9)13/h5-7,14,18H,1H2,2-4H3
InChIKey SHEKEBLWHCCWIE-UHFFFAOYSA-N
Mol Weight 304.3 g/mol
Molecular Formula C16H16O6
Exact Mass 304.094688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KtktzpgKshP
Name 5,7-Dimethoxy-8-(1-oxo-2-hydroxy-3-methyl-3-butenyl)-2H-benzopyran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16O6
InChI InChI=1S/C16H16O6/c1-8(2)14(18)15(19)13-11(21-4)7-10(20-3)9-5-6-12(17)22-16(9)13/h5-7,14,18H,1H2,2-4H3
InChIKey SHEKEBLWHCCWIE-UHFFFAOYSA-N
Molecular Weight 304.298 g/mol
SMILES OC(C(c1c2c(C=CC(O2)=O)c(cc1OC)OC)=O)C(=C)C
SPLASH splash10-001i-0090000000-97781aa12636167094dd
Source of Spectrum E2-50-120-2
Synonyms 8-(2-hydroxy-3-methyl-3-butenoyl)-5,7-dimethoxy-2H-chromen-2-one 8-(2-hydroxy-3-methyl-1-oxobut-3-enyl)-5,7-dimethoxy-1-benzopyran-2-one 8-(2-hydroxy-3-methylbut-3-enoyl)-5,7-dimethoxychromen-2-one 8-(2-hydroxy-3-methyl-but-3-enoyl)-5,7-dimethoxy-chromen-2-one 5,7-Dimethoxy-8-(3-methyl-2-oxidanyl-but-3-enoyl)chromen-2-one
Wiley ID 1555807