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

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	212.09174	145.5
[M+Na]+	234.07368	154.8
[M+NH4]+	229.11828	151.3
[M+K]+	250.04762	151.8
[M-H]-	210.07718	145.2
[M+Na-2H]-	232.05913	148.8
[M]+	211.08391	146.3
[M]-	211.08501	146.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe