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(E)-3-(6-methoxy-8-oxidanyl-1-oxidanylidene-isochromen-3-yl)prop-2-enoic acid
SpectraBase Compound ID 5Ge2QAH9q0z
InChI InChI=1S/C13H10O6/c1-18-9-5-7-4-8(2-3-11(15)16)19-13(17)12(7)10(14)6-9/h2-6,14H,1H3,(H,15,16)/b3-2+
InChIKey CQDRVEJORRYJID-NSCUHMNNSA-N
Mol Weight 262.22 g/mol
Molecular Formula C13H10O6
Exact Mass 262.047738 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GGwIzaNVYJx
Name (E)-3-(6-methoxy-8-oxidanyl-1-oxidanylidene-isochromen-3-yl)prop-2-enoic acid
Alternate Name(s) (E)-3-(8-hydroxy-1-keto-6-methoxy-isochromen-3-yl)acrylic acid (E)-3-(8-hydroxy-6-methoxy-1-oxo-2-benzopyran-3-yl)-2-propenoic acid (E)-3-(8-hydroxy-6-methoxy-1-oxo-isochromen-3-yl)prop-2-enoic acid
CAS Registry Number 66018-44-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10O6
InChI InChI=1S/C13H10O6/c1-18-9-5-7-4-8(2-3-11(15)16)19-13(17)12(7)10(14)6-9/h2-6,14H,1H3,(H,15,16)/b3-2+
InChIKey CQDRVEJORRYJID-NSCUHMNNSA-N
Molecular Weight 262.217 g/mol
SMILES Oc1cc(cc2c1C(OC(\C=C\C(=O)O)=C2)=O)OC
SPLASH splash10-03di-0090000000-348d8f6a8288dc582d0b
Source of Spectrum J-43-2343-0
Wiley ID 1265521