| SpectraBase Spectrum ID |
7ovLFPnjFiz |
| Name |
4-Piperidinol, 4-butyl-1-(phenylmethyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
247.193614428 u |
| Formula |
C16H25NO |
| InChI |
InChI=1S/C16H25NO/c1-2-3-9-16(18)10-12-17(13-11-16)14-15-7-5-4-6-8-15/h4-8,18H,2-3,9-14H2,1H3 |
| InChIKey |
KTLNULDALWGMKW-UHFFFAOYSA-N |
| Molecular Weight |
247.382 g/mol |
| SMILES |
C1=CC(=CC=C1)CN1CCC(CC1)(CCCC)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.839729 |