SpectraBase Spectrum ID |
1L7L1C5pxU8 |
Name |
Piperidine, 1,6-dimethyl-1-[3-phenpropenoryl]- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
243.162314299 u |
Formula |
C16H21NO |
InChI |
InChI=1S/C16H21NO/c1-13-7-6-8-14(2)17(13)16(18)12-11-15-9-4-3-5-10-15/h3-5,9-14H,6-8H2,1-2H3/b12-11+ |
InChIKey |
VTBRAQMXYIIONS-VAWYXSNFSA-N |
Molecular Weight |
243.350 g/mol |
SMILES |
C1=C(C=CC=C1)\C=C\C(=O)N1C(CCCC1C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.819667 |