CID 81207

6711-48-4

Structural Information

Molecular Formula
C10H25N3
SMILES
CN(C)CCCNCCCN(C)C
InChI
InChI=1S/C10H25N3/c1-12(2)9-5-7-11-8-6-10-13(3)4/h11H,5-10H2,1-4H3
InChIKey
BXYVQNNEFZOBOZ-UHFFFAOYSA-N
Compound name
N-[3-(dimethylamino)propyl]-N',N'-dimethylpropane-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

3
References

5892
Patents

187.20485 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.212126 149.9
[M+Na]+ 210.194068 153.1
[M-H]- 186.197574 152.2
[M+NH4]+ 205.238673 170.1
[M+K]+ 226.168008 154.6
[M+H-H2O]+ 170.202110 142.8
[M+HCOO]- 232.203051 176.3
[M+CH3COO]- 246.218701 201.0
[M+Na-2H]- 208.179516 153.7
[M]+ 187.20430142 152.7
[M]- 187.20539858 152.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe