SpectraBase Spectrum ID |
I0yQs1iTcuI |
Name |
1-Methoxy-3-[(E)-2-(4-nitrophenyl)ethenyl]benzene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
255.089543280 u |
Formula |
C15H13NO3 |
InChI |
InChI=1S/C15H13NO3/c1-19-15-4-2-3-13(11-15)6-5-12-7-9-14(10-8-12)16(17)18/h2-11H,1H3/b6-5+ |
InChIKey |
ZKWGCQHPGYOCSV-AATRIKPKSA-N |
Molecular Weight |
255.273 g/mol |
SMILES |
C1(N(=O)=O)=CC=C(\C=C\C=2C=C(OC)C=CC2)C=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.923927 |