SpectraBase Spectrum ID |
5gsYccbSiGv |
Name |
3-(3,4-Dimethoxyphenyl)-2-9P-methoxyphenyl)acrylonitrile |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
295.120843408 u |
Formula |
C18H17NO3 |
InChI |
InChI=1S/C18H17NO3/c1-20-16-7-5-14(6-8-16)15(12-19)10-13-4-9-17(21-2)18(11-13)22-3/h4-11H,1-3H3 |
InChIKey |
XUPZQTOIODRVQV-UHFFFAOYSA-N |
SMILES |
C1=C(C=C(C(=C1)OC)OC)C=C(C=1C=CC(=CC1)OC)C#N |
Spectrum/Structure Validation Score (Raman) |
0.960047 |