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]+ 188.18833 143.3
[M+Na]+ 210.17027 148.2
[M-H]- 186.17377 144.9
[M+NH4]+ 205.21487 163.5
[M+K]+ 226.14421 142.8
[M+H-H2O]+ 170.17831 140.8
[M+HCOO]- 232.17925 166.9
[M+CH3COO]- 246.19490 186.3
[M+Na-2H]- 208.15572 151.2
[M]+ 187.18050 144.2
[M]- 187.18160 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.