| SpectraBase Spectrum ID |
72GXuTQy920 |
| Name |
3-Cyano-7-(diethylamino)coumarin |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
242.105527697 u |
| Formula |
C14H14N2O2 |
| InChI |
InChI=1S/C14H14N2O2/c1-3-16(4-2)12-6-5-10-7-11(9-15)14(17)18-13(10)8-12/h5-8H,3-4H2,1-2H3 |
| InChIKey |
LOUYEVRVQGFIFB-UHFFFAOYSA-N |
| Molecular Weight |
242.278 g/mol |
| SMILES |
C1(=CC=C2C(=C1)OC(=O)C(=C2)C#N)N(CC)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936905 |
