CID 469978

Guanidine, n,n'''-1,2-ethanediylbis[n-methyl-

Structural Information

Molecular Formula
C6H16N6
SMILES
CN(CCN(C)C(=N)N)C(=N)N
InChI
InChI=1S/C6H16N6/c1-11(5(7)8)3-4-12(2)6(9)10/h3-4H2,1-2H3,(H3,7,8)(H3,9,10)
InChIKey
FQJFCCPNXSMHQX-UHFFFAOYSA-N
Compound name
1-[2-[carbamimidoyl(methyl)amino]ethyl]-1-methylguanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

172.14365 Da
Monoisotopic Mass

-1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.15093 141.4
[M+Na]+ 195.13287 144.2
[M-H]- 171.13637 143.7
[M+NH4]+ 190.17747 160.2
[M+K]+ 211.10681 146.2
[M+H-H2O]+ 155.14091 133.7
[M+HCOO]- 217.14185 169.1
[M+CH3COO]- 231.15750 202.0
[M+Na-2H]- 193.11832 143.3
[M]+ 172.14310 135.4
[M]- 172.14420 135.4
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

No patent data available for this compound.