CID 3043660

Metformin xr

Structural Information

Molecular Formula
C4H11N5
SMILES
CN=C(N)N(C)C(=N)N
InChI
InChI=1S/C4H11N5/c1-8-4(7)9(2)3(5)6/h1-2H3,(H3,5,6)(H2,7,8)
InChIKey
LJVNRPAERZRHDF-UHFFFAOYSA-N
Compound name
1-carbamimidoyl-1,2-dimethylguanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

298
Patents

129.10144 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.108716 128.6
[M+Na]+ 152.090658 133.3
[M-H]- 128.094164 131.2
[M+NH4]+ 147.135263 149.7
[M+K]+ 168.064598 135.1
[M+H-H2O]+ 112.098700 121.8
[M+HCOO]- 174.099641 157.0
[M+CH3COO]- 188.115291 188.8
[M+Na-2H]- 150.076106 132.6
[M]+ 129.10089142 123.2
[M]- 129.10198858 123.2
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

patents stripe