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3,4-Dimethoxy-alpha-phenylcinnamonitrile

View entire compound with spectra: 2 NMR, 1 FTIR, 1 Raman, and 1 UV-Vis

3,4-Dimethoxy-alpha-phenylcinnamonitrile
SpectraBase Compound ID 7ofFqDaIVd1
InChI InChI=1S/C17H15NO2/c1-19-16-9-8-13(11-17(16)20-2)10-15(12-18)14-6-4-3-5-7-14/h3-11H,1-2H3
InChIKey PQQFKZSOPMQHDN-UHFFFAOYSA-N
Mol Weight 265.31 g/mol
Molecular Formula C17H15NO2
Exact Mass 265.110279 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID EE93rRkIkOV
Name 3,4-Dimethoxy-alpha-phenylcinnamonitrile
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 265.110278725 u
Formula C17H15NO2
InChI InChI=1S/C17H15NO2/c1-19-16-9-8-13(11-17(16)20-2)10-15(12-18)14-6-4-3-5-7-14/h3-11H,1-2H3
InChIKey PQQFKZSOPMQHDN-UHFFFAOYSA-N
Molecular Weight 265.312 g/mol
SMILES C=1C(=CC(=C(C1)OC)OC)C=C(C#N)C=1C=CC=CC1
Spectrum/Structure Validation Score (Raman) 0.898