CID 226845

Bis(2-amino-2-methylpropyl)amine

Structural Information

Molecular Formula
C8H21N3
SMILES
CC(C)(CNCC(C)(C)N)N
InChI
InChI=1S/C8H21N3/c1-7(2,9)5-11-6-8(3,4)10/h11H,5-6,9-10H2,1-4H3
InChIKey
LAFADOMFLHUDQO-UHFFFAOYSA-N
Compound name
1-N-(2-amino-2-methylpropyl)-2-methylpropane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

159.17355 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.180826 139.3
[M+Na]+ 182.162768 144.0
[M-H]- 158.166274 138.6
[M+NH4]+ 177.207373 159.0
[M+K]+ 198.136708 143.3
[M+H-H2O]+ 142.170810 134.5
[M+HCOO]- 204.171751 161.0
[M+CH3COO]- 218.187401 187.5
[M+Na-2H]- 180.148216 145.1
[M]+ 159.17300142 135.8
[M]- 159.17409858 135.8
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