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Methyl 4-(3-((4-cyanophenyl)(hydroxy)methyl)furan-2-yl)benzoate
SpectraBase Compound ID KQCBmIC9pIW
InChI InChI=1S/C20H15NO4/c1-24-20(23)16-8-6-15(7-9-16)19-17(10-11-25-19)18(22)14-4-2-13(12-21)3-5-14/h2-11,18,22H,1H3
InChIKey OWLMXLFAKOBMLD-UHFFFAOYSA-N
Mol Weight 333.34 g/mol
Molecular Formula C20H15NO4
Exact Mass 333.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9YjImW5ikkz
Name Methyl 4-(3-((4-cyanophenyl)(hydroxy)methyl)furan-2-yl)benzoate
Appearance Pale yellow solid
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Exact Mass 333.100107963 u
Formula C20H15NO4
InChI InChI=1S/C20H15NO4/c1-24-20(23)16-8-6-15(7-9-16)19-17(10-11-25-19)18(22)14-4-2-13(12-21)3-5-14/h2-11,18,22H,1H3
InChIKey OWLMXLFAKOBMLD-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201600961
Molecular Weight 333.343 g/mol
Quality 353
Reported Formula C20H15NO4
SMILES OC(C1=C(OC=C1)C1=CC=C(C=C1)C(=O)OC)C1=CC=C(C=C1)C#N
SPLASH splash10-001i-1349000000-786c1615512f46e831de
Source of Spectrum ACI-55-SM11-11 (DOI: 10.1002/anie.201600961)
Wiley ID 1897350