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2-(4-Methoxyphenyl)-3-oxo-3-(3,4,5-trimethoxyphenyl)-propanenitrile
SpectraBase Compound ID Gt4XnfaGdec
InChI InChI=1S/C19H19NO5/c1-22-14-7-5-12(6-8-14)15(11-20)18(21)13-9-16(23-2)19(25-4)17(10-13)24-3/h5-10,15H,1-4H3
InChIKey ITXWNGCYHJQWFP-UHFFFAOYSA-N
Mol Weight 341.36 g/mol
Molecular Formula C19H19NO5
Exact Mass 341.126323 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CLVWg0mQDvw
Name 2-(4-Methoxyphenyl)-3-oxo-3-(3,4,5-trimethoxyphenyl)-propanenitrile
Appearance Off-white solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H19NO5
InChI InChI=1S/C19H19NO5/c1-22-14-7-5-12(6-8-14)15(11-20)18(21)13-9-16(23-2)19(25-4)17(10-13)24-3/h5-10,15H,1-4H3
InChIKey ITXWNGCYHJQWFP-UHFFFAOYSA-N
Instrument Name Finnigan MAT/INCOS 50
Ionization Type EI
Literature Reference DOI 10.1021/np400310m
Molecular Weight 341.363 g/mol
SMILES c1(OC)c(OC)c(OC)cc(C(=O)C(c2ccc(cc2)OC)C#N)c1
SPLASH splash10-0002-4900000000-88c358951185797fed4a
Source of Spectrum G4-76-1489-11a
Wiley ID 1865693