CID 84607

14721-77-8

Structural Information

Molecular Formula
C8H19N2O2
SMILES
CN(C)C(=O)OCC[N+](C)(C)C
InChI
InChI=1S/C8H19N2O2/c1-9(2)8(11)12-7-6-10(3,4)5/h6-7H2,1-5H3/q+1
InChIKey
SYTFEYDNYKQRMV-UHFFFAOYSA-N
Compound name
2-(dimethylcarbamoyloxy)ethyl-trimethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

24
Patents

175.14465 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.15193 136.5
[M+Na]+ 198.13387 142.5
[M-H]- 174.13737 140.0
[M+NH4]+ 193.17847 157.9
[M+K]+ 214.10781 139.5
[M+H-H2O]+ 158.14191 134.2
[M+HCOO]- 220.14285 161.6
[M+CH3COO]- 234.15850 185.0
[M+Na-2H]- 196.11932 144.9
[M]+ 175.14410 139.2
[M]- 175.14520 139.2
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