SpectraBase Spectrum ID |
KhFuNekRLxX |
Name |
N,N'-bis[2-(1-Piperazinyl)ethyl]dithiooxamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
344.181687274 u |
Formula |
C14H28N6S2 |
InChI |
InChI=1S/C14H28N6S2/c21-13(17-5-11-19-7-1-15-2-8-19)14(22)18-6-12-20-9-3-16-4-10-20/h15-16H,1-12H2,(H,17,21)(H,18,22) |
InChIKey |
VHQRNZLMFMSUFY-UHFFFAOYSA-N |
Molecular Weight |
344.540 g/mol |
SMILES |
N1CCN(CCNC(C(NCCN2CCNCC2)=S)=S)CC1 |
Spectrum/Structure Validation Score (Raman) |
0.992449 |