| SpectraBase Compound ID | HCQRC67KXNX |
|---|---|
| InChI | InChI=1S/C8H20N4/c9-1-3-11-5-7-12(4-2-10)8-6-11/h1-10H2 |
| InChIKey | PAOXFRSJRCGJLV-UHFFFAOYSA-N |
| Mol Weight | 172.28 g/mol |
| Molecular Formula | C8H20N4 |
| Exact Mass | 172.168797 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | J9B24ILRocd |
|---|---|
| Name | 1,4-Piperazinediethanamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 172.168796660 u |
| Formula | C8H20N4 |
| InChI | InChI=1S/C8H20N4/c9-1-3-11-5-7-12(4-2-10)8-6-11/h1-10H2 |
| InChIKey | PAOXFRSJRCGJLV-UHFFFAOYSA-N |
| Molecular Weight | 172.276 g/mol |
| SMILES | C(N)CN1CCN(CC1)CCN |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.971066 |