CID 112485

62351-05-7

Structural Information

Molecular Formula
C11H20NO3
SMILES
CC(=C)C(=O)OCC[N+](C)(C)CC1CO1
InChI
InChI=1S/C11H20NO3/c1-9(2)11(13)14-6-5-12(3,4)7-10-8-15-10/h10H,1,5-8H2,2-4H3/q+1
InChIKey
FWUPLQAHLKYZNL-UHFFFAOYSA-N
Compound name
dimethyl-[2-(2-methylprop-2-enoyloxy)ethyl]-(oxiran-2-ylmethyl)azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

214.14432 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.15160 141.0
[M+Na]+ 237.13354 148.4
[M-H]- 213.13704 147.6
[M+NH4]+ 232.17814 154.3
[M+K]+ 253.10748 143.2
[M+H-H2O]+ 197.14158 137.7
[M+HCOO]- 259.14252 162.5
[M+CH3COO]- 273.15817 189.5
[M+Na-2H]- 235.11899 149.4
[M]+ 214.14377 146.2
[M]- 214.14487 146.2
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.