CID 214728

1,1-dimethylpiperazin-1-ium chloride

Structural Information

Molecular Formula
C6H15N2
SMILES
C[N+]1(CCNCC1)C
InChI
InChI=1S/C6H15N2/c1-8(2)5-3-7-4-6-8/h7H,3-6H2,1-2H3/q+1
InChIKey
CKQFWQCSMNUSRI-UHFFFAOYSA-N
Compound name
1,1-dimethylpiperazin-1-ium
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

657
Patents

115.12352 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.13080 123.4
[M+Na]+ 138.11274 136.7
[M+NH4]+ 133.15734 134.8
[M+K]+ 154.08668 129.2
[M-H]- 114.11624 126.1
[M+Na-2H]- 136.09819 131.5
[M]+ 115.12297 126.5
[M]- 115.12407 126.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe