CID 14461

Dimethylguanidine

Structural Information

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

2D Structure

compound 2d structure
6
Annotation Hits

5
References

31630
Patents

87.07965 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 88.086926 117.1
[M+Na]+ 110.06887 123.3
[M-H]- 86.072374 118.9
[M+NH4]+ 105.11347 140.3
[M+K]+ 126.04281 124.7
[M+H-H2O]+ 70.076910 111.8
[M+HCOO]- 132.07785 143.9
[M+CH3COO]- 146.09350 174.7
[M+Na-2H]- 108.05432 123.1
[M]+ 87.079101 113.5
[M]- 87.080199 113.5
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

No patent data available for this compound.