(E)-1-[2',5'-Dimethyl-4'-(2''-hydroxyethoxy)phenyl]-2-(2',4'-dinitrophenyl)ethene

SpectraBase Compound ID	69vdB81N4mi
InChI	InChI=1S/C18H18N2O6/c1-12-10-18(26-8-7-21)13(2)9-15(12)4-3-14-5-6-16(19(22)23)11-17(14)20(24)25/h3-6,9-11,21H,7-8H2,1-2H3/b4-3+
InChIKey	IMSXANIQEBOSIW-ONEGZZNKSA-N Google Search
Mol Weight	358.35 g/mol
Molecular Formula	C18H18N2O6
Exact Mass	358.116486 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	6zCVGKN1Jn3
Name	(E)-1-[2',5'-Dimethyl-4'-(2''-hydroxyethoxy)phenyl]-2-(2',4'-dinitrophenyl)ethene
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	358.116486302 u
Formula	C18H18N2O6
InChI	InChI=1S/C18H18N2O6/c1-12-10-18(26-8-7-21)13(2)9-15(12)4-3-14-5-6-16(19(22)23)11-17(14)20(24)25/h3-6,9-11,21H,7-8H2,1-2H3/b4-3+
InChIKey	IMSXANIQEBOSIW-ONEGZZNKSA-N
Molecular Weight	358.350 g/mol
SMILES	C1(N(=O)=O)=CC(N(=O)=O)=CC=C1\C=C\C1=CC(C)=C(C=C1C)OCCO
Spectrum/Structure Validation Score (Vapor Phase IR)	0.92797