SpectraBase Spectrum ID |
GhxzTctB5JG |
Name |
1-(3,4-Difluorobenzyl)-4-piperidinamine, N-acetyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
268.138719533 u |
Formula |
C14H18F2N2O |
InChI |
InChI=1S/C14H18F2N2O/c1-10(19)17-12-4-6-18(7-5-12)9-11-2-3-13(15)14(16)8-11/h2-3,8,12H,4-7,9H2,1H3,(H,17,19) |
InChIKey |
VBBKHZAXIMSSIE-UHFFFAOYSA-N |
Molecular Weight |
268.308 g/mol |
SMILES |
C(C1=CC(F)=C(C=C1)F)N1CCC(CC1)NC(C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.976436 |