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]+ 210.07608 142.3
[M+Na]+ 232.05802 149.1
[M-H]- 208.06152 146.1
[M+NH4]+ 227.10262 160.6
[M+K]+ 248.03196 148.9
[M+H-H2O]+ 192.06606 135.8
[M+HCOO]- 254.06700 166.9
[M+CH3COO]- 268.08265 188.5
[M+Na-2H]- 230.04347 147.2
[M]+ 209.06825 145.3
[M]- 209.06935 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.