CID 3048263

1,2'-ethylenebis(1,2-dimethylpyrrolidinium) diiodide

Structural Information

Molecular Formula
C14H29N2
SMILES
CC1CCC(N1C)CC[N+]2(CCCC2C)C
InChI
InChI=1S/C14H29N2/c1-12-7-8-14(15(12)3)9-11-16(4)10-5-6-13(16)2/h12-14H,5-11H2,1-4H3/q+1
InChIKey
VZTRZYNMAKUTHU-UHFFFAOYSA-N
Compound name
2-[2-(1,2-dimethylpyrrolidin-1-ium-1-yl)ethyl]-1,5-dimethylpyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.23308 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.24036 155.5
[M+Na]+ 248.22230 161.4
[M-H]- 224.22580 159.2
[M+NH4]+ 243.26690 176.8
[M+K]+ 264.19624 153.5
[M+H-H2O]+ 208.23034 151.3
[M+HCOO]- 270.23128 172.6
[M+CH3COO]- 284.24693 185.7
[M+Na-2H]- 246.20775 156.1
[M]+ 225.23253 151.0
[M]- 225.23363 151.0
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

No patent data available for this compound.