SpectraBase Spectrum ID |
2A1hqP1swN4 |
Name |
1-Benzyl-4-piperidinamine, N-heptafluorobutyryl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
386.122910315 u |
Formula |
C16H17F7N2O |
InChI |
InChI=1S/C16H17F7N2O/c17-14(18,15(19,20)16(21,22)23)13(26)24-12-6-8-25(9-7-12)10-11-4-2-1-3-5-11/h1-5,12H,6-10H2,(H,24,26) |
InChIKey |
UNRZQDSMYJRCBK-UHFFFAOYSA-N |
Molecular Weight |
386.314 g/mol |
SMILES |
C1N(CCC(C1)NC(=O)C(C(C(F)(F)F)(F)F)(F)F)CC1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.873485 |