SpectraBase Spectrum ID |
4Th2Zvuh1Cs |
Name |
3.alpha.-Hydroxy-3-methyl-6-phenyl-4-piperidone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
205.110278725 u |
Formula |
C12H15NO2 |
InChI |
InChI=1S/C12H15NO2/c1-12(15)8-13-10(7-11(12)14)9-5-3-2-4-6-9/h2-6,10,13,15H,7-8H2,1H3 |
InChIKey |
FCHSENMMULOZQO-UHFFFAOYSA-N |
Molecular Weight |
205.257 g/mol |
SMILES |
C1(CC(C(CN1)(C)O)=O)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.965076 |