CID 15853

Dibutadiamin dihydrochloride

Structural Information

Molecular Formula
C8H20N2
SMILES
CC(C)(C)NCCCCN
InChI
InChI=1S/C8H20N2/c1-8(2,3)10-7-5-4-6-9/h10H,4-7,9H2,1-3H3
InChIKey
JAUBXQBMUWRRNS-UHFFFAOYSA-N
Compound name
N'-tert-butylbutane-1,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

81
Patents

144.16264 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.16992 135.1
[M+Na]+ 167.15186 143.1
[M+NH4]+ 162.19646 142.8
[M+K]+ 183.12580 138.0
[M-H]- 143.15536 135.3
[M+Na-2H]- 165.13731 138.5
[M]+ 144.16209 136.0
[M]- 144.16319 136.0
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