CID 21508029

4-(dimethylamino)butanimidamide dihydrochloride

Structural Information

Molecular Formula
C6H15N3
SMILES
CN(C)CCCC(=N)N
InChI
InChI=1S/C6H15N3/c1-9(2)5-3-4-6(7)8/h3-5H2,1-2H3,(H3,7,8)
InChIKey
IPGXJXHUXGPVFD-UHFFFAOYSA-N
Compound name
4-(dimethylamino)butanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

129.1266 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.133876 130.7
[M+Na]+ 152.115818 135.5
[M-H]- 128.119324 131.8
[M+NH4]+ 147.160423 152.1
[M+K]+ 168.089758 136.1
[M+H-H2O]+ 112.123860 124.7
[M+HCOO]- 174.124801 156.4
[M+CH3COO]- 188.140451 184.6
[M+Na-2H]- 150.101266 135.1
[M]+ 129.12605142 128.3
[M]- 129.12714858 128.3
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