| SpectraBase Spectrum ID |
FirZKTDcAy9 |
| Name |
3-(3-Methoxyphenyl)-1-propylpyrrolidine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
219.162314299 u |
| Formula |
C14H21NO |
| InChI |
InChI=1S/C14H21NO/c1-3-8-15-9-7-13(11-15)12-5-4-6-14(10-12)16-2/h4-6,10,13H,3,7-9,11H2,1-2H3 |
| InChIKey |
FWJGHQRTPNUZIV-UHFFFAOYSA-N |
| Molecular Weight |
219.328 g/mol |
| SMILES |
C1N(CCC1C=1C=C(OC)C=CC1)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.959264 |
