CID 116307

64039-03-8

Structural Information

Molecular Formula
C20H42N2O2
SMILES
C[N+]1(CCOCC1)CCCCCCCCCC[N+]2(CCOCC2)C
InChI
InChI=1S/C20H42N2O2/c1-21(13-17-23-18-14-21)11-9-7-5-3-4-6-8-10-12-22(2)15-19-24-20-16-22/h3-20H2,1-2H3/q+2
InChIKey
ONIQSYIXYLOIPA-UHFFFAOYSA-N
Compound name
4-methyl-4-[10-(4-methylmorpholin-4-ium-4-yl)decyl]morpholin-4-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

342.32462 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.33190 187.6
[M+Na]+ 365.31384 186.8
[M-H]- 341.31734 189.7
[M+NH4]+ 360.35844 198.4
[M+K]+ 381.28778 175.4
[M+H-H2O]+ 325.32188 183.2
[M+HCOO]- 387.32282 196.1
[M+CH3COO]- 401.33847 198.9
[M+Na-2H]- 363.29929 194.5
[M]+ 342.32407 182.4
[M]- 342.32517 182.4
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

patents stripe