CID 13466087

104662-24-0

Structural Information

Molecular Formula

C₁₅H₁₀O₂

SMILES

C1=CC=C2C=C3C(=CC2=C1)C=CC(=C3O)C=O

InChI

InChI=1S/C15H10O2/c16-9-13-6-5-12-7-10-3-1-2-4-11(10)8-14(12)15(13)17/h1-9,17H

InChIKey

FHOKZPOKSFRTJX-UHFFFAOYSA-N

Compound name

1-hydroxyanthracene-2-carbaldehyde

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 222.06808 Da
Monoisotopic Mass: 4.1
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]+	223.075356	144.6
[M+Na]+	245.057298	155.8
[M-H]-	221.060804	149.8
[M+NH4]+	240.101903	164.8
[M+K]+	261.031238	150.5
[M+H-H2O]+	205.065340	138.3
[M+HCOO]-	267.066281	167.4
[M+CH3COO]-	281.081931	158.6
[M+Na-2H]-	243.042746	154.5
[M]+	222.06753142	147.0
[M]-	222.06862858	147.0

Literature stripe

literature stripe

Patent stripe

patents stripe