CID 24845568

1-(2-guanidinoethyl)-1-methylpyrrolidinium iodide hydriodide

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]+ 172.16824 136.0
[M+Na]+ 194.15018 144.2
[M+NH4]+ 189.19478 146.0
[M+K]+ 210.12412 140.1
[M-H]- 170.15368 139.5
[M+Na-2H]- 192.13563 142.1
[M]+ 171.16041 138.1
[M]- 171.16151 138.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.