CID 135431232

134283-49-1

Structural Information

Molecular Formula
C8H9NO3
SMILES
COC1=C(C=CC(=C1)/C=N/O)O
InChI
InChI=1S/C8H9NO3/c1-12-8-4-6(5-9-11)2-3-7(8)10/h2-5,10-11H,1H3/b9-5+
InChIKey
RJJVVYVLHWMYAA-WEVVVXLNSA-N
Compound name
4-[(E)-hydroxyiminomethyl]-2-methoxyphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

17
Patents

167.05824 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.06552 131.3
[M+Na]+ 190.04746 139.9
[M-H]- 166.05096 134.3
[M+NH4]+ 185.09206 151.3
[M+K]+ 206.02140 138.3
[M+H-H2O]+ 150.05550 125.7
[M+HCOO]- 212.05644 156.6
[M+CH3COO]- 226.07209 177.4
[M+Na-2H]- 188.03291 138.5
[M]+ 167.05769 132.5
[M]- 167.05879 132.5
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.