CID 178244240

2-hydroxy-n-(2-methylprop-2-enoyl)ethanimine oxide

Structural Information

Molecular Formula
C6H9NO3
SMILES
CC(=C)C(=O)[N+](=CCO)[O-]
InChI
InChI=1S/C6H9NO3/c1-5(2)6(9)7(10)3-4-8/h3,8H,1,4H2,2H3
InChIKey
NZOQNSXTOWMFDI-UHFFFAOYSA-N
Compound name
2-hydroxy-N-(2-methylprop-2-enoyl)ethanimine oxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

143.05824 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.065516 129.0
[M+Na]+ 166.047458 135.5
[M-H]- 142.050964 128.2
[M+NH4]+ 161.092063 149.1
[M+K]+ 182.021398 130.6
[M+H-H2O]+ 126.055500 129.5
[M+HCOO]- 188.056441 151.4
[M+CH3COO]- 202.072091 165.4
[M+Na-2H]- 164.032906 133.9
[M]+ 143.05769142 125.9
[M]- 143.05878858 125.9
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.