CID 135580648

3,4-dihydroxy-5-methoxybenzaldehyde oxime

Structural Information

Molecular Formula
C8H9NO4
SMILES
COC1=CC(=CC(=C1O)O)/C=N\O
InChI
InChI=1S/C8H9NO4/c1-13-7-3-5(4-9-12)2-6(10)8(7)11/h2-4,10-12H,1H3/b9-4-
InChIKey
WCHGNHSEDPOLIQ-WTKPLQERSA-N
Compound name
5-[(Z)-hydroxyiminomethyl]-3-methoxybenzene-1,2-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.05316 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.06044 134.4
[M+Na]+ 206.04238 143.4
[M-H]- 182.04588 136.3
[M+NH4]+ 201.08698 153.2
[M+K]+ 222.01632 141.5
[M+H-H2O]+ 166.05042 129.0
[M+HCOO]- 228.05136 158.3
[M+CH3COO]- 242.06701 178.4
[M+Na-2H]- 204.02783 140.3
[M]+ 183.05261 135.5
[M]- 183.05371 135.5
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.