CID 6364639

Ammonium (z)-alpha-methoxyimino-2-furylacetate

Structural Information

Molecular Formula
C7H7NO4
SMILES
CO/N=C(\C1=CC=CO1)/C(=O)O
InChI
InChI=1S/C7H7NO4/c1-11-8-6(7(9)10)5-3-2-4-12-5/h2-4H,1H3,(H,9,10)/b8-6+
InChIKey
ZNQCEVIJOQZWLO-SOFGYWHQSA-N
Compound name
(2E)-2-(furan-2-yl)-2-methoxyiminoacetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

100
Patents

169.0375 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.04478 132.3
[M+Na]+ 192.02672 139.4
[M-H]- 168.03022 136.8
[M+NH4]+ 187.07132 152.4
[M+K]+ 208.00066 140.8
[M+H-H2O]+ 152.03476 126.5
[M+HCOO]- 214.03570 157.6
[M+CH3COO]- 228.05135 177.6
[M+Na-2H]- 190.01217 138.1
[M]+ 169.03695 134.9
[M]- 169.03805 134.9
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.