CID 217390

4,9-diazadodecanedialdehyde dihydrochloride

Structural Information

Molecular Formula
C10H20N2O2
SMILES
C(CCNCCC=O)CNCCC=O
InChI
InChI=1S/C10H20N2O2/c13-9-3-7-11-5-1-2-6-12-8-4-10-14/h9-12H,1-8H2
InChIKey
WPBJCXUUUSDQJO-UHFFFAOYSA-N
Compound name
3-[4-(3-oxopropylamino)butylamino]propanal
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

5
References

95
Patents

200.15248 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.15976 148.0
[M+Na]+ 223.14170 155.2
[M+NH4]+ 218.18630 153.9
[M+K]+ 239.11564 149.0
[M-H]- 199.14520 147.3
[M+Na-2H]- 221.12715 150.2
[M]+ 200.15193 148.2
[M]- 200.15303 148.2
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