CID 81393

Tetramethylpiperazinium diiodide

Structural Information

Molecular Formula
C8H20N2
SMILES
C[N+]1(CC[N+](CC1)(C)C)C
InChI
InChI=1S/C8H20N2/c1-9(2)5-7-10(3,4)8-6-9/h5-8H2,1-4H3/q+2
InChIKey
RONLMHFJDWTADA-UHFFFAOYSA-N
Compound name
1,1,4,4-tetramethylpiperazine-1,4-diium
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

2
References

161
Patents

144.16264 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.169916 126.0
[M+Na]+ 167.151858 133.3
[M-H]- 143.155364 127.5
[M+NH4]+ 162.196463 148.7
[M+K]+ 183.125798 122.2
[M+H-H2O]+ 127.159900 126.4
[M+HCOO]- 189.160841 143.1
[M+CH3COO]- 203.176491 163.8
[M+Na-2H]- 165.137306 138.1
[M]+ 144.16209142 120.1
[M]- 144.16318858 120.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe