SpectraBase Compound ID | 9ciAjEzKTqE |
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InChI | InChI=1S/C8H20N4/c9-1-2-10-3-6-12-7-4-11-5-8-12/h10-11H,1-9H2 |
InChIKey | WBIWIXJUBVWKLS-UHFFFAOYSA-N |
Mol Weight | 172.28 g/mol |
Molecular Formula | C8H20N4 |
Exact Mass | 172.168797 g/mol |
SpectraBase Spectrum ID | 20voOkf0meJ |
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Name | N1-(2-(Piperazin-1-yl)ethyl)ethane-1,2-diamine |
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/c9-1-2-10-3-6-12-7-4-11-5-8-12/h10-11H,1-9H2 |
InChIKey | WBIWIXJUBVWKLS-UHFFFAOYSA-N |
Molecular Weight | 172.276 g/mol |
SMILES | C(N)CNCCN1CCNCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.984813 |