| SpectraBase Compound ID | 9ISeHtdSlhe |
|---|---|
| InChI | InChI=1S/C14H22N2/c1-2-8-15-9-11-16(12-10-15)13-14-6-4-3-5-7-14/h3-7H,2,8-13H2,1H3 |
| InChIKey | MMOMLVPXKBCSMG-UHFFFAOYSA-N |
| Mol Weight | 218.34 g/mol |
| Molecular Formula | C14H22N2 |
| Exact Mass | 218.178299 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4wKRc53ZP8r |
|---|---|
| Name | 1-Benzyl-4-propylpiperazine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.178298716 u |
| Formula | C14H22N2 |
| InChI | InChI=1S/C14H22N2/c1-2-8-15-9-11-16(12-10-15)13-14-6-4-3-5-7-14/h3-7H,2,8-13H2,1H3 |
| InChIKey | MMOMLVPXKBCSMG-UHFFFAOYSA-N |
| Molecular Weight | 218.344 g/mol |
| SMILES | C(N1CCN(CC1)CCC)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.971828 |