CID 20668853

N,n,n',n'-tetramethyl-2,2-dimethyl-1,3-propanediamine

Structural Information

Molecular Formula
C9H22N2
SMILES
CC(C)(CN(C)C)CN(C)C
InChI
InChI=1S/C9H22N2/c1-9(2,7-10(3)4)8-11(5)6/h7-8H2,1-6H3
InChIKey
MOBAUGYLXJCSAW-UHFFFAOYSA-N
Compound name
N,N,N',N',2,2-hexamethylpropane-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

142
Patents

158.1783 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.18558 140.0
[M+Na]+ 181.16752 145.1
[M-H]- 157.17102 143.1
[M+NH4]+ 176.21212 162.1
[M+K]+ 197.14146 147.3
[M+H-H2O]+ 141.17556 134.6
[M+HCOO]- 203.17650 164.3
[M+CH3COO]- 217.19215 193.5
[M+Na-2H]- 179.15297 145.1
[M]+ 158.17775 142.9
[M]- 158.17885 142.9
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