| SpectraBase Spectrum ID |
FOkcryH43hC |
| Name |
(2-Methylpiperidino)-(4-nitrophenyl)amine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
235.132076797 u |
| Formula |
C12H17N3O2 |
| InChI |
InChI=1S/C12H17N3O2/c1-10-4-2-3-9-14(10)13-11-5-7-12(8-6-11)15(16)17/h5-8,10,13H,2-4,9H2,1H3 |
| InChIKey |
PLGPKXHARYVGAW-UHFFFAOYSA-N |
| Molecular Weight |
235.287 g/mol |
| SMILES |
C=1(N(=O)=O)C=CC(NN2C(C)CCCC2)=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932649 |
