CID 575777

25177-85-9

Structural Information

Molecular Formula

C₁₀H₁₀O₂

SMILES

C1C(CC2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C10H10O2/c11-10(12)9-5-7-3-1-2-4-8(7)6-9/h1-4,9H,5-6H2,(H,11,12)

InChIKey

XUDCMQBOWOLYCF-UHFFFAOYSA-N

Compound name

2,3-dihydro-1H-indene-2-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 6
References: 1101
Patents: 162.06808 Da
Monoisotopic Mass: 1.7
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]+	163.07536	132.8
[M+Na]+	185.05730	144.2
[M+NH4]+	180.10190	142.0
[M+K]+	201.03124	140.1
[M-H]-	161.06080	134.3
[M+Na-2H]-	183.04275	137.8
[M]+	162.06753	134.7
[M]-	162.06863	134.7

Literature stripe

literature stripe

Patent stripe

patents stripe