CID 11009533

1-butyl-1-methylpyrrolidinium bromide

Structural Information

Molecular Formula
C9H20N
SMILES
CCCC[N+]1(CCCC1)C
InChI
InChI=1S/C9H20N/c1-3-4-7-10(2)8-5-6-9-10/h3-9H2,1-2H3/q+1
InChIKey
PXELHGDYRQLRQO-UHFFFAOYSA-N
Compound name
1-butyl-1-methylpyrrolidin-1-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

41
References

8032
Patents

142.15958 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.16686 132.1
[M+Na]+ 165.14880 138.2
[M-H]- 141.15230 133.9
[M+NH4]+ 160.19340 156.0
[M+K]+ 181.12274 131.8
[M+H-H2O]+ 125.15684 129.5
[M+HCOO]- 187.15778 152.8
[M+CH3COO]- 201.17343 168.3
[M+Na-2H]- 163.13425 139.4
[M]+ 142.15903 128.8
[M]- 142.16013 128.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe