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2-Isopropyl-5-(phenylmethyl)-3-furancarboxylic acid methyl ester
SpectraBase Compound ID 8h44lqjv0Ag
InChI InChI=1S/C16H18O3/c1-11(2)15-14(16(17)18-3)10-13(19-15)9-12-7-5-4-6-8-12/h4-8,10-11H,9H2,1-3H3
InChIKey ZPWISCMVYAAVOX-UHFFFAOYSA-N
Mol Weight 258.32 g/mol
Molecular Formula C16H18O3
Exact Mass 258.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EW3shQty7lD
Name 2-Isopropyl-5-(phenylmethyl)-3-furancarboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O3
InChI InChI=1S/C16H18O3/c1-11(2)15-14(16(17)18-3)10-13(19-15)9-12-7-5-4-6-8-12/h4-8,10-11H,9H2,1-3H3
InChIKey ZPWISCMVYAAVOX-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol502371j
Molecular Weight 258.317 g/mol
SMILES c1cc(ccc1)Cc1cc(c(o1)C(C)C)C(=O)OC
SPLASH splash10-052f-2290000000-2f85fa5b0113213e8ab0
Source of Spectrum A1-16-4862/SMS11-3e
Synonyms Methyl 5-benzyl-2-isopropylfuran-3-carboxylate
Wiley ID 1751283