CID 24845568

92876-64-7

Structural Information

Molecular Formula
C8H19N4
SMILES
C[N+]1(CCCC1)CCN=C(N)N
InChI
InChI=1S/C8H19N4/c1-12(5-2-3-6-12)7-4-11-8(9)10/h2-7H2,1H3,(H4,9,10,11)/q+1
InChIKey
FFISHJWNOKUZKD-UHFFFAOYSA-N
Compound name
2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

171.16096 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.168236 134.1
[M+Na]+ 194.150178 138.4
[M-H]- 170.153684 136.3
[M+NH4]+ 189.194783 155.7
[M+K]+ 210.124118 132.0
[M+H-H2O]+ 154.158220 130.3
[M+HCOO]- 216.159161 157.6
[M+CH3COO]- 230.174811 179.5
[M+Na-2H]- 192.135626 140.7
[M]+ 171.16041142 126.7
[M]- 171.16150858 126.7
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

No patent data available for this compound.