| SpectraBase Spectrum ID |
EHbbgLYauSi |
| Name |
N-(1-(4-Fluorophenyl)propan-2-yl)cyclopropanamine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
193.126677682 u |
| Formula |
C12H16FN |
| InChI |
InChI=1S/C12H16FN/c1-9(14-12-6-7-12)8-10-2-4-11(13)5-3-10/h2-5,9,12,14H,6-8H2,1H3 |
| InChIKey |
OVVNOPFYKMIFHN-UHFFFAOYSA-N |
| Molecular Weight |
193.265 g/mol |
| SMILES |
C1C(C1)NC(C)CC1=CC=C(F)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.873108 |