CID 139594856

Ns00078573

Structural Information

Molecular Formula
C10H13NO4
SMILES
CCOC(=O)C(NC1=CC=C(C=C1)O)O
InChI
InChI=1S/C10H13NO4/c1-2-15-10(14)9(13)11-7-3-5-8(12)6-4-7/h3-6,9,11-13H,2H2,1H3
InChIKey
VUHPVWDQYTYDBM-UHFFFAOYSA-N
Compound name
ethyl 2-hydroxy-2-(4-hydroxyanilino)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.08446 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.091736 145.0
[M+Na]+ 234.073678 150.7
[M-H]- 210.077184 146.0
[M+NH4]+ 229.118283 161.9
[M+K]+ 250.047618 149.3
[M+H-H2O]+ 194.081720 138.9
[M+HCOO]- 256.082661 166.3
[M+CH3COO]- 270.098311 183.8
[M+Na-2H]- 232.059126 148.8
[M]+ 211.08391142 144.8
[M]- 211.08500858 144.8
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

No patent data available for this compound.