CID 21555042

2,3-dihydro-1h-indene-2,5-diol

Structural Information

Molecular Formula

C₉H₁₀O₂

SMILES

C1C(CC2=C1C=CC(=C2)O)O

InChI

InChI=1S/C9H10O2/c10-8-2-1-6-3-9(11)5-7(6)4-8/h1-2,4,9-11H,3,5H2

InChIKey

XNXNPJAZZGQZRD-UHFFFAOYSA-N

Compound name

2,3-dihydro-1H-indene-2,5-diol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 29
Patents: 150.06808 Da
Monoisotopic Mass: 1.2
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]+	151.07536	128.5
[M+Na]+	173.05730	140.3
[M+NH4]+	168.10190	137.9
[M+K]+	189.03124	136.2
[M-H]-	149.06080	130.1
[M+Na-2H]-	171.04275	133.5
[M]+	150.06753	130.5
[M]-	150.06863	130.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe