CID 116292

Morpholinium, 4,4'-tetramethylenebis(4-methyl-, dibromide

Structural Information

Molecular Formula
C14H30N2O2
SMILES
C[N+]1(CCOCC1)CCCC[N+]2(CCOCC2)C
InChI
InChI=1S/C14H30N2O2/c1-15(7-11-17-12-8-15)5-3-4-6-16(2)9-13-18-14-10-16/h3-14H2,1-2H3/q+2
InChIKey
AMBURQOTZFYMLK-UHFFFAOYSA-N
Compound name
4-methyl-4-[4-(4-methylmorpholin-4-ium-4-yl)butyl]morpholin-4-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

258.23074 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.238016 160.9
[M+Na]+ 281.219958 162.7
[M-H]- 257.223464 164.3
[M+NH4]+ 276.264563 175.1
[M+K]+ 297.193898 152.7
[M+H-H2O]+ 241.228000 157.7
[M+HCOO]- 303.228941 171.5
[M+CH3COO]- 317.244591 181.3
[M+Na-2H]- 279.205406 171.0
[M]+ 258.23019142 153.8
[M]- 258.23128858 153.8
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