SpectraBase Spectrum ID |
1Kp2BFKX5eF |
Name |
Spiro[cyclohexanol-3,6'-hexahydropyridin-2-one] (cis)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
183.125928789 u |
Formula |
C10H17NO2 |
InChI |
InChI=1S/C10H17NO2/c12-8-3-1-5-10(7-8)6-2-4-9(13)11-10/h8,12H,1-7H2,(H,11,13) |
InChIKey |
KQJYNGLVJSFIJZ-UHFFFAOYSA-N |
Molecular Weight |
183.251 g/mol |
SMILES |
C1CCC2(CC1O)NC(CCC2)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.914413 |