CID 3048214

Pyrrolidinium, 1,1'-oxydiethylenebis(1-methyl-, diiodide

Structural Information

Molecular Formula
C14H30N2O
SMILES
C[N+]1(CCCC1)CCOCC[N+]2(CCCC2)C
InChI
InChI=1S/C14H30N2O/c1-15(7-3-4-8-15)11-13-17-14-12-16(2)9-5-6-10-16/h3-14H2,1-2H3/q+2
InChIKey
RXOPQPRVJQPDRJ-UHFFFAOYSA-N
Compound name
1-methyl-1-[2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]ethyl]pyrrolidin-1-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

242.23581 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.24309 159.6
[M+Na]+ 265.22503 163.2
[M-H]- 241.22853 162.6
[M+NH4]+ 260.26963 180.7
[M+K]+ 281.19897 150.9
[M+H-H2O]+ 225.23307 157.4
[M+HCOO]- 287.23401 176.2
[M+CH3COO]- 301.24966 179.0
[M+Na-2H]- 263.21048 165.4
[M]+ 242.23526 154.0
[M]- 242.23636 154.0
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