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3-(6-Methoxybenzofuran-2-carbonyl)azulene-1-carboxylic acid methyl ester
SpectraBase Compound ID HjfNo520F5u
InChI InChI=1S/C22H16O5/c1-25-14-9-8-13-10-20(27-19(13)11-14)21(23)17-12-18(22(24)26-2)16-7-5-3-4-6-15(16)17/h3-12H,1-2H3
InChIKey KFDRQFDLVVZCCA-UHFFFAOYSA-N
Mol Weight 360.37 g/mol
Molecular Formula C22H16O5
Exact Mass 360.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1IIHnXssNM
Name 3-(6-Methoxybenzofuran-2-carbonyl)azulene-1-carboxylic acid methyl ester
Alternate Name(s) 3-[(6-methoxy-2-benzofuranyl)-oxomethyl]-1-azulenecarboxylic acid methyl ester Methyl 3-(6-methoxy-1-benzofuran-2-carbonyl)azulene-1-carboxylate Methyl 3-(6-methoxybenzofuran-2-carbonyl)azulene-1-carboxylate Methyl 3-[(6-methoxy-1-benzofuran-2-yl)carbonyl]azulene-1-carboxylate
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Formula C22H16O5
InChI InChI=1S/C22H16O5/c1-25-14-9-8-13-10-20(27-19(13)11-14)21(23)17-12-18(22(24)26-2)16-7-5-3-4-6-15(16)17/h3-12H,1-2H3
InChIKey KFDRQFDLVVZCCA-UHFFFAOYSA-N
Molecular Weight 360.365 g/mol
SMILES c1(c2c(ccccc2)c(c1)C(=O)OC)C(c1oc2cc(OC)ccc2c1)=O
SPLASH splash10-03di-0019000000-7f21563eff23f7d0a80d
Source of Spectrum D8-39-683-11
Wiley ID 1528467