SpectraBase Spectrum ID |
ILICnCdQas9 |
Name |
3-Amino-8-ethoxymethyleneamino-1-(4-methoxyphenyl)-1H-benzo[H]chromene-2-carbonitrile |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
399.158291545 u |
Formula |
C24H21N3O3 |
InChI |
InChI=1S/C24H21N3O3/c1-3-29-14-27-21-6-4-5-18-17(21)11-12-19-22(15-7-9-16(28-2)10-8-15)20(13-25)24(26)30-23(18)19/h4-12,14,22H,3,26H2,1-2H3/b27-14+ |
InChIKey |
CVVSJYIPKSAJEA-MZJWZYIUSA-N |
Molecular Weight |
399.450 g/mol |
SMILES |
C1(=C(OC2=C(C1C1=CC=C(C=C1)OC)C=CC=1C(\N=C\OCC)=CC=CC21)N)C#N |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.870863 |