CID 575464

1h-indene-2-carboxylic acid

Structural Information

Molecular Formula

C₁₀H₈O₂

SMILES

C1C2=CC=CC=C2C=C1C(=O)O

InChI

InChI=1S/C10H8O2/c11-10(12)9-5-7-3-1-2-4-8(7)6-9/h1-5H,6H2,(H,11,12)

InChIKey

BINGGEWUXWUXMJ-UHFFFAOYSA-N

Compound name

1H-indene-2-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 215
Patents: 160.05243 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]+	161.05971	131.3
[M+Na]+	183.04165	143.6
[M+NH4]+	178.08625	140.5
[M+K]+	199.01559	139.3
[M-H]-	159.04515	133.0
[M+Na-2H]-	181.02710	137.2
[M]+	160.05188	133.4
[M]-	160.05298	133.4

Literature stripe

literature stripe

Patent stripe

patents stripe