CID 24208966

(formyl-2-methoxyanilino)acetic acid

Structural Information

Molecular Formula
C10H11NO4
SMILES
COC1=CC=CC=C1N(CC(=O)O)C=O
InChI
InChI=1S/C10H11NO4/c1-15-9-5-3-2-4-8(9)11(7-12)6-10(13)14/h2-5,7H,6H2,1H3,(H,13,14)
InChIKey
BDJCKOFWQPCFTD-UHFFFAOYSA-N
Compound name
2-(N-formyl-2-methoxyanilino)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

209.0688 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.076076 142.3
[M+Na]+ 232.058018 149.1
[M-H]- 208.061524 146.1
[M+NH4]+ 227.102623 160.6
[M+K]+ 248.031958 148.9
[M+H-H2O]+ 192.066060 135.8
[M+HCOO]- 254.067001 166.9
[M+CH3COO]- 268.082651 188.5
[M+Na-2H]- 230.043466 147.2
[M]+ 209.06825142 145.3
[M]- 209.06934858 145.3
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.