CID 3520

Guanidine

Structural Information

Molecular Formula
CH5N3
SMILES
C(=N)(N)N
InChI
InChI=1S/CH5N3/c2-1(3)4/h(H5,2,3,4)
InChIKey
ZRALSGWEFCBTJO-UHFFFAOYSA-N
Compound name
guanidine
Related CIDs

2D Structure

compound 2d structure
10
Annotation Hits

9268
References

190010
Patents

59.048347 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 60.055623 107.6
[M+Na]+ 82.037565 114.3
[M-H]- 58.041071 107.6
[M+NH4]+ 77.082170 130.8
[M+K]+ 98.011505 114.4
[M+H-H2O]+ 42.045607 102.8
[M+HCOO]- 104.04655 133.8
[M+CH3COO]- 118.06220 165.2
[M+Na-2H]- 80.023013 114.3
[M]+ 59.047798 101.0
[M]- 59.048896 101.0
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.