CID 24842377

103622-39-5

Structural Information

Molecular Formula
C26H56N4
SMILES
CC[N+]1(CCN(CC1)CCCCCCCCCCN2CC[N+](CC2)(CC)CC)CC
InChI
InChI=1S/C26H56N4/c1-5-29(6-2)23-19-27(20-24-29)17-15-13-11-9-10-12-14-16-18-28-21-25-30(7-3,8-4)26-22-28/h5-26H2,1-4H3/q+2
InChIKey
OWEDJAQHEWUGNE-UHFFFAOYSA-N
Compound name
4-[10-(4,4-diethylpiperazin-4-ium-1-yl)decyl]-1,1-diethylpiperazin-1-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

424.4505 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 425.45778 211.8
[M+Na]+ 447.43972 210.4
[M-H]- 423.44322 209.5
[M+NH4]+ 442.48432 219.9
[M+K]+ 463.41366 194.5
[M+H-H2O]+ 407.44776 205.1
[M+HCOO]- 469.44870 217.2
[M+CH3COO]- 483.46435 219.6
[M+Na-2H]- 445.42517 213.4
[M]+ 424.44995 206.4
[M]- 424.45105 206.4
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.