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2-[2-(3-methoxy-2-thienyl)-4-oxo-chromen-8-yl]acetic acid
SpectraBase Compound ID DlEsXzG6xEj
InChI InChI=1S/C16H12O5S/c1-20-12-5-6-22-16(12)13-8-11(17)10-4-2-3-9(7-14(18)19)15(10)21-13/h2-6,8H,7H2,1H3,(H,18,19)
InChIKey ISKXNCOOFAIBCD-UHFFFAOYSA-N
Mol Weight 316.33 g/mol
Molecular Formula C16H12O5S
Exact Mass 316.040545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3S16nFQftA
Name 2-[2-(3-methoxy-2-thienyl)-4-oxo-chromen-8-yl]acetic acid
Alternate Name(s) 2-[2-(3-methoxy-2-thiophenyl)-4-oxo-1-benzopyran-8-yl]acetic acid 2-(2-(3-methoxythiophen-2-yl)-4-oxo-4H-chromen-8-yl)acetic acid 2-[2-(3-methoxythiophen-2-yl)-4-oxidanylidene-chromen-8-yl]ethanoic acid 2-[2-(3-methoxythiophen-2-yl)-4-oxochromen-8-yl]acetic acid 2-[4-keto-2-(3-methoxy-2-thienyl)chromen-8-yl]acetic acid
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Formula C16H12O5S
InChI InChI=1S/C16H12O5S/c1-20-12-5-6-22-16(12)13-8-11(17)10-4-2-3-9(7-14(18)19)15(10)21-13/h2-6,8H,7H2,1H3,(H,18,19)
InChIKey ISKXNCOOFAIBCD-UHFFFAOYSA-N
Literature Reference DOI 10.1002_(SICI)1521-4184(199812)331_12_405
Molecular Weight 316.327 g/mol
SMILES OC(Cc1cccc2c1OC(c1c(ccs1)OC)=CC2=O)=O
SPLASH splash10-01t9-9724000000-2edfa4ab41e6cc2c3f83
Source of Spectrum APP-331-409-8f
Wiley ID 1770255