CID 117447

Propionamide, n,n-dimethyl-3-(1-methylpyrrolidin-1'-yl)-, iodide

Structural Information

Molecular Formula
C10H21N2O
SMILES
CN(C)C(=O)CC[N+]1(CCCC1)C
InChI
InChI=1S/C10H21N2O/c1-11(2)10(13)6-9-12(3)7-4-5-8-12/h4-9H2,1-3H3/q+1
InChIKey
PODFQEWXPWXFRX-UHFFFAOYSA-N
Compound name
N,N-dimethyl-3-(1-methylpyrrolidin-1-ium-1-yl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.16539 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.17267 141.9
[M+Na]+ 208.15461 146.9
[M-H]- 184.15811 145.1
[M+NH4]+ 203.19921 164.2
[M+K]+ 224.12855 141.7
[M+H-H2O]+ 168.16265 138.7
[M+HCOO]- 230.16359 163.2
[M+CH3COO]- 244.17924 180.2
[M+Na-2H]- 206.14006 147.3
[M]+ 185.16484 139.4
[M]- 185.16594 139.4
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

No patent data available for this compound.