CID 74089363

Ns00124208

Structural Information

Molecular Formula
C6H7NO4
SMILES
CON=C1C=COC1C(=O)O
InChI
InChI=1S/C6H7NO4/c1-10-7-4-2-3-11-5(4)6(8)9/h2-3,5H,1H3,(H,8,9)
InChIKey
OVMQXMQQWBPXSQ-UHFFFAOYSA-N
Compound name
3-methoxyiminofuran-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

157.0375 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.044776 127.9
[M+Na]+ 180.026718 135.7
[M-H]- 156.030224 132.5
[M+NH4]+ 175.071323 148.9
[M+K]+ 196.000658 137.0
[M+H-H2O]+ 140.034760 122.7
[M+HCOO]- 202.035701 153.1
[M+CH3COO]- 216.051351 175.3
[M+Na-2H]- 178.012166 134.0
[M]+ 157.03695142 129.8
[M]- 157.03804858 129.8
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

patents stripe