CID 118213

35092-67-2

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

211.08446 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.09174 145.3
[M+Na]+ 234.07368 151.9
[M-H]- 210.07718 146.1
[M+NH4]+ 229.11828 162.2
[M+K]+ 250.04762 150.3
[M+H-H2O]+ 194.08172 139.4
[M+HCOO]- 256.08266 165.9
[M+CH3COO]- 270.09831 184.6
[M+Na-2H]- 232.05913 147.2
[M]+ 211.08391 144.5
[M]- 211.08501 144.5
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