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4-bromobenzoic acid [(3E)-2-keto-3-(5-keto-3-methoxy-4-methyl-2-furylidene)-6-methoxy-7-methyl-benzofuran-5-yl] ester
SpectraBase Compound ID 2htMWIV1xw2
InChI InChI=1S/C23H17BrO8/c1-10-17-14(16(23(27)31-17)20-19(29-4)11(2)21(25)32-20)9-15(18(10)28-3)30-22(26)12-5-7-13(24)8-6-12/h5-9H,1-4H3/b20-16+
InChIKey YBEWQCLFXCSEHH-CAPFRKAQSA-N
Mol Weight 501.29 g/mol
Molecular Formula C23H17BrO8
Exact Mass 500.01068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1DcuI9bk8ap
Name 5-(p-Bromobenzoyl)oxy-6-methoxy-7-methyl-3-(5-oxo-4-methyl-3-methoxydihydro-2-furanylidene)benzo[b]furan-2-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H17BrO8
InChI InChI=1S/C23H17BrO8/c1-10-17-14(16(23(27)31-17)20-19(29-4)11(2)21(25)32-20)9-15(18(10)28-3)30-22(26)12-5-7-13(24)8-6-12/h5-9H,1-4H3/b20-16+
InChIKey YBEWQCLFXCSEHH-CAPFRKAQSA-N
Molecular Weight 501.285 g/mol
SMILES C=1(\C(=C/2C(Oc3c2cc(c(OC)c3C)OC(c2ccc(cc2)Br)=O)=O)OC(C1C)=O)OC
SPLASH splash10-0f8i-0900030000-92900ab4ff2cb17e7c9c
Source of Spectrum E2-46-1234-9
Synonyms (3E)-6-methoxy-3-(3-methoxy-4-methyl-5-oxo-2(5H)-furanylidene)-7-methyl-2-oxo-2,3-dihydro-1-benzofuran-5-yl 4-bromobenzoate 5-(p-Bromobenzoyl)-6-methoxy-7-methyl-3-(5-oxo-4-methyl-3-methoxydihydro-2-furanylidene)benzo[b]furan-2-one 4-Bromobenzoic acid [(3E)-6-methoxy-3-(3-methoxy-4-methyl-5-oxo-2-furanylidene)-7-methyl-2-oxo-5-benzofuranyl] ester [(3E)-6-methoxy-3-(3-methoxy-4-methyl-5-oxofuran-2-ylidene)-7-methyl-2-oxo-1-benzofuran-5-yl] 4-bromobenzoate [(3E)-6-methoxy-3-(3-methoxy-4-methyl-5-oxo-2-furylidene)-7-methyl-2-oxo-benzofuran-5-yl] 4-bromobenzoate [(3E)-6-methoxy-3-(3-methoxy-4-methyl-5-oxidanylidene-furan-2-ylidene)-7-methyl-2-oxidanylidene-1-benzofuran-5-yl] 4-bromanylbenzoate
Wiley ID 1554506