| SpectraBase Spectrum ID |
5bfS3tlVVhc |
| Name |
3-Ethoxy-2,2-diphenyl-5-propyl-2H-pyrrole |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
305.177964364 u |
| Formula |
C21H23NO |
| InChI |
InChI=1S/C21H23NO/c1-3-11-19-16-20(23-4-2)21(22-19,17-12-7-5-8-13-17)18-14-9-6-10-15-18/h5-10,12-16H,3-4,11H2,1-2H3 |
| InChIKey |
ZUDFJHIZSSQXHC-UHFFFAOYSA-N |
| Molecular Weight |
305.421 g/mol |
| SMILES |
C1(C(=CC(=N1)CCC)OCC)(C=1C=CC=CC1)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.910541 |
