CID 86087

16888-78-1

Structural Information

Molecular Formula
C20H43N5
SMILES
CC(C)CC(=NCCNCCNCCNCCN=C(C)CC(C)C)C
InChI
InChI=1S/C20H43N5/c1-17(2)15-19(5)24-13-11-22-9-7-21-8-10-23-12-14-25-20(6)16-18(3)4/h17-18,21-23H,7-16H2,1-6H3
InChIKey
PVXILHYGUROBHU-UHFFFAOYSA-N
Compound name
N'-[2-(4-methylpentan-2-ylideneamino)ethyl]-N-[2-[2-(4-methylpentan-2-ylideneamino)ethylamino]ethyl]ethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

353.35184 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.35912 200.4
[M+Na]+ 376.34106 198.1
[M-H]- 352.34456 201.0
[M+NH4]+ 371.38566 212.9
[M+K]+ 392.31500 197.2
[M+H-H2O]+ 336.34910 190.7
[M+HCOO]- 398.35004 223.8
[M+CH3COO]- 412.36569 239.5
[M+Na-2H]- 374.32651 197.2
[M]+ 353.35129 202.4
[M]- 353.35239 202.4
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

No patent data available for this compound.