| SpectraBase Spectrum ID |
Ft9mMCx3cBv |
| Name |
4-(Benzylamino)-3-(piperidinomethyl)coumarin |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
348.183778019 u |
| Formula |
C22H24N2O2 |
| InChI |
InChI=1S/C22H24N2O2/c25-22-19(16-24-13-7-2-8-14-24)21(18-11-5-6-12-20(18)26-22)23-15-17-9-3-1-4-10-17/h1,3-6,9-12,23H,2,7-8,13-16H2 |
| InChIKey |
IIJZJENXWARXBH-UHFFFAOYSA-N |
| Molecular Weight |
348.446 g/mol |
| SMILES |
C1=CC=C2C(=C1)OC(=O)C(=C2NCC1=CC=CC=C1)CN1CCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.802087 |
