CID 469929

N1,n2-diisopropyl-1,2-propanediamine

Structural Information

Molecular Formula
C9H22N2
SMILES
CC(C)NCC(C)NC(C)C
InChI
InChI=1S/C9H22N2/c1-7(2)10-6-9(5)11-8(3)4/h7-11H,6H2,1-5H3
InChIKey
FUJUAXDOMMJSRK-UHFFFAOYSA-N
Compound name
1-N,2-N-di(propan-2-yl)propane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

37
Patents

158.1783 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.18558 142.9
[M+Na]+ 181.16752 146.5
[M-H]- 157.17102 142.8
[M+NH4]+ 176.21212 163.2
[M+K]+ 197.14146 146.8
[M+H-H2O]+ 141.17556 137.3
[M+HCOO]- 203.17650 164.7
[M+CH3COO]- 217.19215 188.6
[M+Na-2H]- 179.15297 144.8
[M]+ 158.17775 141.7
[M]- 158.17885 141.7
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

No patent data available for this compound.