CID 135492011

1,2-cyclohexanedione, 1,2-dioxime

Structural Information

Molecular Formula
C6H10N2O2
SMILES
C1CCC(=NO)C(=NO)C1
InChI
InChI=1S/C6H10N2O2/c9-7-5-3-1-2-4-6(5)8-10/h9-10H,1-4H2
InChIKey
CUNNCKOPAWXYDX-UHFFFAOYSA-N
Compound name
N-(2-hydroxyiminocyclohexylidene)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

1837
Patents

142.07423 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.08151 126.8
[M+Na]+ 165.06345 132.2
[M-H]- 141.06695 130.0
[M+NH4]+ 160.10805 147.5
[M+K]+ 181.03739 131.4
[M+H-H2O]+ 125.07149 121.0
[M+HCOO]- 187.07243 150.8
[M+CH3COO]- 201.08808 175.2
[M+Na-2H]- 163.04890 133.5
[M]+ 142.07368 121.4
[M]- 142.07478 121.4
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.