CID 18659999

15753-91-0

Structural Information

Molecular Formula
C18H38N4
SMILES
CC(C)CC(=NCCNCCNCCN=C(C)CC(C)C)C
InChI
InChI=1S/C18H38N4/c1-15(2)13-17(5)21-11-9-19-7-8-20-10-12-22-18(6)14-16(3)4/h15-16,19-20H,7-14H2,1-6H3
InChIKey
MALQDLVGQHDICZ-UHFFFAOYSA-N
Compound name
N,N'-bis[2-(4-methylpentan-2-ylideneamino)ethyl]ethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

98
Patents

310.30966 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.316936 188.9
[M+Na]+ 333.298878 188.3
[M-H]- 309.302384 190.0
[M+NH4]+ 328.343483 203.7
[M+K]+ 349.272818 187.7
[M+H-H2O]+ 293.306920 180.2
[M+HCOO]- 355.307861 212.1
[M+CH3COO]- 369.323511 228.5
[M+Na-2H]- 331.284326 186.3
[M]+ 310.30911142 191.0
[M]- 310.31020858 191.0
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