CID 22743653

N1,n1,3-trimethylbutane-1,3-diamine dihydrochloride

Structural Information

Molecular Formula
C7H18N2
SMILES
CC(C)(CCN(C)C)N
InChI
InChI=1S/C7H18N2/c1-7(2,8)5-6-9(3)4/h5-6,8H2,1-4H3
InChIKey
XJZJEGHBTQCDKG-UHFFFAOYSA-N
Compound name
1-N,1-N,3-trimethylbutane-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
Patents

130.147 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.15428 130.9
[M+Na]+ 153.13622 139.3
[M+NH4]+ 148.18082 139.0
[M+K]+ 169.11016 134.9
[M-H]- 129.13972 131.5
[M+Na-2H]- 151.12167 134.8
[M]+ 130.14645 132.1
[M]- 130.14755 132.1
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