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2-Benzofuran-2-yl-3,3-dimethylbutanoic acid methyl ester
SpectraBase Compound ID 16QwNYXuqGw
InChI InChI=1S/C15H18O3/c1-15(2,3)13(14(16)17-4)12-9-10-7-5-6-8-11(10)18-12/h5-9,13H,1-4H3
InChIKey KCAXJVJHNDJKLJ-UHFFFAOYSA-N
Mol Weight 246.31 g/mol
Molecular Formula C15H18O3
Exact Mass 246.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IW6chIEHNsV
Name 2-Benzofuran-2-yl-3,3-dimethylbutanoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O3
InChI InChI=1S/C15H18O3/c1-15(2,3)13(14(16)17-4)12-9-10-7-5-6-8-11(10)18-12/h5-9,13H,1-4H3
InChIKey KCAXJVJHNDJKLJ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200606037
Molecular Weight 246.306 g/mol
SMILES c1cc2cc(C(C(C)(C)C)C(OC)=O)oc2cc1
SPLASH splash10-052f-1900000000-50f98839407e868c68f3
Source of Spectrum ASC-348-1101/SM13-2c
Synonyms Methyl 2-(benzofuran-2-yl)-3,3-dimethylbutanoate
Wiley ID 1765273