| SpectraBase Spectrum ID |
8Flk4DGGpcQ |
| Name |
N-(1,3-Benzodioxol-5-ylmethyl)cyclopentanamine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
219.125928789 u |
| Formula |
C13H17NO2 |
| InChI |
InChI=1S/C13H17NO2/c1-2-4-11(3-1)14-8-10-5-6-12-13(7-10)16-9-15-12/h5-7,11,14H,1-4,8-9H2 |
| InChIKey |
LOYZMUZNAPZSOX-UHFFFAOYSA-N |
| Molecular Weight |
219.284 g/mol |
| SMILES |
C1(CCCC1)NCC1=CC=C2OCOC2=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.930027 |
