CID 40662

2-acetamidoethyltriethylammonium iodide

Structural Information

Molecular Formula
C10H23N2O
SMILES
CC[N+](CC)(CC)CCNC(=O)C
InChI
InChI=1S/C10H22N2O/c1-5-12(6-2,7-3)9-8-11-10(4)13/h5-9H2,1-4H3/p+1
InChIKey
GNDGQGGOOSLVSC-UHFFFAOYSA-O
Compound name
2-acetamidoethyl(triethyl)azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

187.18105 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.188326 143.3
[M+Na]+ 210.170268 148.2
[M-H]- 186.173774 144.9
[M+NH4]+ 205.214873 163.5
[M+K]+ 226.144208 142.8
[M+H-H2O]+ 170.178310 140.8
[M+HCOO]- 232.179251 166.9
[M+CH3COO]- 246.194901 186.3
[M+Na-2H]- 208.155716 151.2
[M]+ 187.18050142 144.2
[M]- 187.18159858 144.2
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.