CID 178244255

2,2-dimethoxy-n-(2-methylprop-2-enoyl)ethanimine oxide

Structural Information

Molecular Formula
C8H13NO4
SMILES
CC(=C)C(=O)[N+](=CC(OC)OC)[O-]
InChI
InChI=1S/C8H13NO4/c1-6(2)8(10)9(11)5-7(12-3)13-4/h5,7H,1H2,2-4H3
InChIKey
PLQJYWFFFOHEGS-UHFFFAOYSA-N
Compound name
2,2-dimethoxy-N-(2-methylprop-2-enoyl)ethanimine oxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.08446 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.091736 140.8
[M+Na]+ 210.073678 146.6
[M-H]- 186.077184 141.1
[M+NH4]+ 205.118283 159.8
[M+K]+ 226.047618 143.1
[M+H-H2O]+ 170.081720 140.6
[M+HCOO]- 232.082661 163.3
[M+CH3COO]- 246.098311 177.2
[M+Na-2H]- 208.059126 144.1
[M]+ 187.08391142 141.1
[M]- 187.08500858 141.1
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.