SpectraBase Compound ID | Aq4DXDXoFLb |
---|---|
InChI | InChI=1S/C12H24N2/c13-11-7-9-14(10-8-11)12-5-3-1-2-4-6-12/h11-12H,1-10,13H2 |
InChIKey | RKFJCZXYGHNXBR-UHFFFAOYSA-N |
Mol Weight | 196.34 g/mol |
Molecular Formula | C12H24N2 |
Exact Mass | 196.193949 g/mol |
SpectraBase Spectrum ID | CJ0YXQeK8iw |
---|---|
Name | 1-Cycloheptyl-4-piperidinamine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 196.193948781 u |
Formula | C12H24N2 |
InChI | InChI=1S/C12H24N2/c13-11-7-9-14(10-8-11)12-5-3-1-2-4-6-12/h11-12H,1-10,13H2 |
InChIKey | RKFJCZXYGHNXBR-UHFFFAOYSA-N |
Molecular Weight | 196.338 g/mol |
SMILES | C1N(CCC(C1)N)C1CCCCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.977639 |