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5-[3-(4-hydroxyphenyl)-7-oxidanyl-4-oxidanylidene-chromen-2-yl]pentanoic acid
SpectraBase Compound ID LInUbJMuWUp
InChI InChI=1S/C20H18O6/c21-13-7-5-12(6-8-13)19-16(3-1-2-4-18(23)24)26-17-11-14(22)9-10-15(17)20(19)25/h5-11,21-22H,1-4H2,(H,23,24)
InChIKey AMZMYDFFWJDBRK-UHFFFAOYSA-N
Mol Weight 354.36 g/mol
Molecular Formula C20H18O6
Exact Mass 354.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5f63AYj0MqW
Name 5-[3-(4-hydroxyphenyl)-7-oxidanyl-4-oxidanylidene-chromen-2-yl]pentanoic acid
Alternate Name(s) 5-[7-hydroxy-3-(4-hydroxyphenyl)-4-keto-chromen-2-yl]valeric acid 5-[7-hydroxy-3-(4-hydroxyphenyl)-4-oxo-1-benzopyran-2-yl]pentanoic acid 5-[7-hydroxy-3-(4-hydroxyphenyl)-4-oxo-chromen-2-yl]pentanoic acid
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Formula C20H18O6
InChI InChI=1S/C20H18O6/c21-13-7-5-12(6-8-13)19-16(3-1-2-4-18(23)24)26-17-11-14(22)9-10-15(17)20(19)25/h5-11,21-22H,1-4H2,(H,23,24)
InChIKey AMZMYDFFWJDBRK-UHFFFAOYSA-N
Molecular Weight 354.358 g/mol
SMILES OC(CCCCC=1Oc2cc(ccc2C(C1c1ccc(cc1)O)=O)O)=O
SPLASH splash10-0f89-1194000000-0789dc052a683be82c4b
Source of Spectrum SO-20-415-3
Wiley ID 877537