CID 19349920

4-(methylamino)benzene-1-carboximidamide dihydrochloride

Structural Information

Molecular Formula
C8H11N3
SMILES
CNC1=CC=C(C=C1)C(=N)N
InChI
InChI=1S/C8H11N3/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5,11H,1H3,(H3,9,10)
InChIKey
TYYHBFZDQVQALI-UHFFFAOYSA-N
Compound name
4-(methylamino)benzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

45
Patents

149.09529 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.10257 130.6
[M+Na]+ 172.08451 136.9
[M-H]- 148.08801 134.1
[M+NH4]+ 167.12911 150.7
[M+K]+ 188.05845 134.6
[M+H-H2O]+ 132.09255 124.3
[M+HCOO]- 194.09349 157.1
[M+CH3COO]- 208.10914 183.5
[M+Na-2H]- 170.06996 137.1
[M]+ 149.09474 125.9
[M]- 149.09584 125.9
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