CID 199670

336 hc

Structural Information

Molecular Formula
C22H46N4
SMILES
CC[N+]1(CCCCC1)CCN2CCN(CC2)CC[N+]3(CCCCC3)CC
InChI
InChI=1S/C22H46N4/c1-3-25(17-7-5-8-18-25)21-15-23-11-13-24(14-12-23)16-22-26(4-2)19-9-6-10-20-26/h3-22H2,1-2H3/q+2
InChIKey
ZNHCIZMTKNYVHQ-UHFFFAOYSA-N
Compound name
1,4-bis[2-(1-ethylpiperidin-1-ium-1-yl)ethyl]piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

366.37225 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.37953 197.8
[M+Na]+ 389.36147 195.1
[M-H]- 365.36497 198.1
[M+NH4]+ 384.40607 206.8
[M+K]+ 405.33541 180.0
[M+H-H2O]+ 349.36951 189.4
[M+HCOO]- 411.37045 201.4
[M+CH3COO]- 425.38610 204.2
[M+Na-2H]- 387.34692 200.3
[M]+ 366.37170 183.7
[M]- 366.37280 183.7
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.