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

3
Patents

129.1266 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.13388 130.7
[M+Na]+ 152.11582 135.5
[M-H]- 128.11932 131.8
[M+NH4]+ 147.16042 152.1
[M+K]+ 168.08976 136.1
[M+H-H2O]+ 112.12386 124.7
[M+HCOO]- 174.12480 156.4
[M+CH3COO]- 188.14045 184.6
[M+Na-2H]- 150.10127 135.1
[M]+ 129.12605 128.3
[M]- 129.12715 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