SpectraBase Spectrum ID |
4e3DUXMyuUV |
Name |
2-Piperidinobicyclo[3.3.1]nonan-9-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
221.177964364 u |
Formula |
C14H23NO |
InChI |
InChI=1S/C14H23NO/c16-14-11-5-4-6-12(14)13(8-7-11)15-9-2-1-3-10-15/h11-13H,1-10H2/t11-,12+,13?/m1/s1 |
InChIKey |
RVZATTSXQJHIRB-OJRHAOMCSA-N |
Molecular Weight |
221.344 g/mol |
SMILES |
[C@]12(C([C@](C(CC2)N2CCCCC2)(CCC1)[H])=O)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.97279 |