SpectraBase Spectrum ID |
KaSsldrSADj |
Name |
1-Benzyl-1-aza-spiro[4.5]decane-2,7-dione |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
257.141578854 u |
Formula |
C16H19NO2 |
InChI |
InChI=1S/C16H19NO2/c18-14-7-4-9-16(11-14)10-8-15(19)17(16)12-13-5-2-1-3-6-13/h1-3,5-6H,4,7-12H2 |
InChIKey |
TVMGKYXCSJKEIL-UHFFFAOYSA-N |
Molecular Weight |
257.333 g/mol |
SMILES |
C12(N(C(CC2)=O)CC=2C=CC=CC2)CC(=O)CCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.961688 |