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3-Benzofuranacetic acid, 2,3-dihydro-7-methoxy-5-methyl-, ethyl ester
SpectraBase Compound ID KLX0B6pd5Tl
InChI InChI=1S/C14H18O4/c1-4-17-13(15)7-10-8-18-14-11(10)5-9(2)6-12(14)16-3/h5-6,10H,4,7-8H2,1-3H3
InChIKey KDDWVLAHQTWHFO-UHFFFAOYSA-N
Mol Weight 250.29 g/mol
Molecular Formula C14H18O4
Exact Mass 250.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5XEIuydmuab
Name 3-Benzofuranacetic acid, 2,3-dihydro-7-methoxy-5-methyl-, ethyl ester
CAS Registry Number 111726-58-0
Comments Less than 3 mono-isotopic peaks
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Formula C14H18O4
InChI InChI=1S/C14H18O4/c1-4-17-13(15)7-10-8-18-14-11(10)5-9(2)6-12(14)16-3/h5-6,10H,4,7-8H2,1-3H3
InChIKey KDDWVLAHQTWHFO-UHFFFAOYSA-N
Molecular Weight 250.294 g/mol
SMILES c12c(C(CC(=O)OCC)CO2)cc(cc1OC)C
SPLASH splash10-0002-0940000000-4998b7890a00dd8165c6
Source of Spectrum I-65-2022-12
Synonyms 2,3-Dihydro-7-methoxy-5-methyl-3-benzofuranacetic acid ethyl ester ethyl (7-methoxy-5-methyl-2,3-dihydro-1-benzofuran-3-yl)acetate
Wiley ID 1253335