CID 131423106

2-hydroxy-n-methylpropan-1-imine oxide

Structural Information

Molecular Formula
C4H9NO2
SMILES
CC(C=[N+](C)[O-])O
InChI
InChI=1S/C4H9NO2/c1-4(6)3-5(2)7/h3-4,6H,1-2H3
InChIKey
FMMXUAGIBUVXME-UHFFFAOYSA-N
Compound name
2-hydroxy-N-methylpropan-1-imine oxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

103.06333 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 104.070606 119.3
[M+Na]+ 126.052548 126.2
[M-H]- 102.056054 118.7
[M+NH4]+ 121.097153 141.2
[M+K]+ 142.026488 122.3
[M+H-H2O]+ 86.060590 120.2
[M+HCOO]- 148.061531 142.7
[M+CH3COO]- 162.077181 159.5
[M+Na-2H]- 124.037996 126.3
[M]+ 103.06278142 116.2
[M]- 103.06387858 116.2
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.