CID 3307867

3-(dimethylamino)propanimidamide dihydrochloride

Structural Information

Molecular Formula
C5H13N3
SMILES
CN(C)CCC(=N)N
InChI
InChI=1S/C5H13N3/c1-8(2)4-3-5(6)7/h3-4H2,1-2H3,(H3,6,7)
InChIKey
LIYWOKKWHOKFBA-UHFFFAOYSA-N
Compound name
3-(dimethylamino)propanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

115.11095 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.118226 126.1
[M+Na]+ 138.100168 131.3
[M-H]- 114.103674 127.4
[M+NH4]+ 133.144773 148.1
[M+K]+ 154.074108 132.2
[M+H-H2O]+ 98.108210 120.3
[M+HCOO]- 160.109151 152.2
[M+CH3COO]- 174.124801 181.5
[M+Na-2H]- 136.085616 131.0
[M]+ 115.11040142 123.3
[M]- 115.11149858 123.3
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