SpectraBase Spectrum ID |
3aVKZgh2EPX |
Name |
4-Methyl-3-(2-nitro-1-phenylethyl)-7-diethylaminocoumarin |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
380.173607257 u |
Formula |
C22H24N2O4 |
InChI |
InChI=1S/C22H24N2O4/c1-4-23(5-2)17-11-12-18-15(3)21(22(25)28-20(18)13-17)19(14-24(26)27)16-9-7-6-8-10-16/h6-13,19H,4-5,14H2,1-3H3 |
InChIKey |
LTKKYWZLJZISRH-UHFFFAOYSA-N |
Molecular Weight |
380.444 g/mol |
SMILES |
C=1(C(OC2=C(C1C)C=CC(N(CC)CC)=C2)=O)C(CN(=O)=O)C=1C=CC=CC1 |