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4-Hydroxy-7-methoxy-5-benzo(B)pyran-propionic acid, methyl ester
SpectraBase Compound ID G6v4lTjCllP
InChI InChI=1S/C13H14O5/c1-16-10-7-8(3-4-11(14)17-2)12(15)9-5-6-18-13(9)10/h5-7,15H,3-4H2,1-2H3
InChIKey SLPKZHVQCNBTHP-UHFFFAOYSA-N
Mol Weight 250.25 g/mol
Molecular Formula C13H14O5
Exact Mass 250.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ZXjsGLCvDf
Name 5-Benzofuranpropanoic acid, 4-hydroxy-7-methoxy-, methyl ester
CAS Registry Number 115678-85-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O5
InChI InChI=1S/C13H14O5/c1-16-10-7-8(3-4-11(14)17-2)12(15)9-5-6-18-13(9)10/h5-7,15H,3-4H2,1-2H3
InChIKey SLPKZHVQCNBTHP-UHFFFAOYSA-N
Molecular Weight 250.250 g/mol
SMILES Oc1c2c(c(OC)cc1CCC(=O)OC)occ2
SPLASH splash10-00or-0950000000-ed3c8384d3e86a817dc2
Source of Spectrum C-110-7429-26
Synonyms Methyl 3-(4-hydroxy-7-methoxy-1-benzofuran-5-yl)propanoate Methyl 4-hydroxy-7-methoxy-5-benzo[b]pyranpropionate
Wiley ID 1253084