CID 230867

N,n'-dimethylguanidine hydroiodide

Structural Information

Molecular Formula
C3H9N3
SMILES
CNC(=NC)N
InChI
InChI=1S/C3H9N3/c1-5-3(4)6-2/h1-2H3,(H3,4,5,6)
InChIKey
LINDOXZENKYESA-UHFFFAOYSA-N
Compound name
1,2-dimethylguanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

15015
Patents

87.07965 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 88.086926 116.4
[M+Na]+ 110.06887 122.9
[M-H]- 86.072374 118.1
[M+NH4]+ 105.11347 139.7
[M+K]+ 126.04281 123.8
[M+H-H2O]+ 70.076910 111.1
[M+HCOO]- 132.07785 144.2
[M+CH3COO]- 146.09350 173.1
[M+Na-2H]- 108.05432 123.7
[M]+ 87.079101 113.4
[M]- 87.080199 113.4
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