SpectraBase Spectrum ID |
Dv7ehiToYR9 |
Name |
1-Piperidinecarboxy-o-toluidide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
218.141913207 u |
Formula |
C13H18N2O |
InChI |
InChI=1S/C13H18N2O/c1-11-7-3-4-8-12(11)14-13(16)15-9-5-2-6-10-15/h3-4,7-8H,2,5-6,9-10H2,1H3,(H,14,16) |
InChIKey |
BTBNZCCPHWAHGE-UHFFFAOYSA-N |
Molecular Weight |
218.300 g/mol |
SMILES |
N(C(N1CCCCC1)=O)C=1C(=CC=CC1)C |
Spectrum/Structure Validation Score (Raman) |
0.923557 |