CID 24901151

6-hydroxy-2,3-dihydro-1h-indene-4-carbaldehyde

Structural Information

Molecular Formula

C₁₀H₁₀O₂

SMILES

C1CC2=C(C1)C(=CC(=C2)O)C=O

InChI

InChI=1S/C10H10O2/c11-6-8-5-9(12)4-7-2-1-3-10(7)8/h4-6,12H,1-3H2

InChIKey

SKBQQCVQPDIEEL-UHFFFAOYSA-N

Compound name

6-hydroxy-2,3-dihydro-1H-indene-4-carbaldehyde

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 162.06808 Da
Monoisotopic Mass: 1.9
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	131.5
[M+Na]+	185.05730	140.5
[M-H]-	161.06080	135.1
[M+NH4]+	180.10190	154.8
[M+K]+	201.03124	137.4
[M+H-H2O]+	145.06534	126.9
[M+HCOO]-	207.06628	154.1
[M+CH3COO]-	221.08193	174.9
[M+Na-2H]-	183.04275	137.2
[M]+	162.06753	130.9
[M]-	162.06863	130.9

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.