CID 26578

Carbonic acid, ethyl ester, ester with salicylic acid

Structural Information

Molecular Formula

C₁₀H₁₀O₅

SMILES

CCOC(=O)OC1=CC=CC=C1C(=O)O

InChI

InChI=1S/C10H10O5/c1-2-14-10(13)15-8-6-4-3-5-7(8)9(11)12/h3-6H,2H2,1H3,(H,11,12)

InChIKey

CULQSUABDCVMTA-UHFFFAOYSA-N

Compound name

2-ethoxycarbonyloxybenzoic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 39
Patents: 210.05283 Da
Monoisotopic Mass: 2.0
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]+	211.06011	143.1
[M+Na]+	233.04205	153.8
[M+NH4]+	228.08665	149.1
[M+K]+	249.01599	150.1
[M-H]-	209.04555	142.5
[M+Na-2H]-	231.02750	147.5
[M]+	210.05228	144.1
[M]-	210.05338	144.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe