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Iso-calycine
SpectraBase Compound ID AmTL3ZhOhi0
InChI InChI=1S/C18H10O5/c19-15-13(10-6-2-1-3-7-10)17(20)23-16(15)14-11-8-4-5-9-12(11)22-18(14)21/h1-9,19H/b16-14-
InChIKey CGRCGRBHNKRILW-PEZBUJJGSA-N
Mol Weight 306.27 g/mol
Molecular Formula C18H10O5
Exact Mass 306.052823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FrPiiwf9zzU
Name Iso-calycine
Alternate Name(s) 5-[2'-Oxo-2H-benzufuran-3'-ylidene]-3-phenyl-4-hydroxy-2,5-dihydroduran-2-one (3Z)-3-(3-hydroxy-5-oxo-4-phenyl-2-furanylidene)-2-benzofuranone (3Z)-3-(3-hydroxy-5-oxo-4-phenylfuran-2-ylidene)-1-benzofuran-2-one (3Z)-3-(3-hydroxy-5-oxo-4-phenyl-2-furylidene)benzofuran-2-one (3Z)-3-(3-oxidanyl-5-oxidanylidene-4-phenyl-furan-2-ylidene)-1-benzofuran-2-one
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Formula C18H10O5
InChI InChI=1S/C18H10O5/c19-15-13(10-6-2-1-3-7-10)17(20)23-16(15)14-11-8-4-5-9-12(11)22-18(14)21/h1-9,19H/b16-14-
InChIKey CGRCGRBHNKRILW-PEZBUJJGSA-N
Molecular Weight 306.273 g/mol
SMILES OC1=C(c2ccccc2)C(O\C1=C\1C(Oc2c1cccc2)=O)=O
SPLASH splash10-004i-9104000000-af2187b9b7a71353b622
Source of Spectrum ES-2005-3473-0
Wiley ID 1563541