| SpectraBase Spectrum ID |
Iz7OBIQ9nWe |
| Name |
2-Piperidinovalerophenone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
245.177964364 u |
| Formula |
C16H23NO |
| InChI |
InChI=1S/C16H23NO/c1-2-9-15(17-12-7-4-8-13-17)16(18)14-10-5-3-6-11-14/h3,5-6,10-11,15H,2,4,7-9,12-13H2,1H3 |
| InChIKey |
HAKYNKHTDUXTRZ-UHFFFAOYSA-N |
| Molecular Weight |
245.366 g/mol |
| SMILES |
C(C(C1=CC=CC=C1)=O)(N1CCCCC1)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94458 |
