CID 283974

1-hydroxy-1-methylnaphthalen-2(1h)-one

Structural Information

Molecular Formula

C₁₁H₁₀O₂

SMILES

CC1(C(=O)C=CC2=CC=CC=C21)O

InChI

InChI=1S/C11H10O2/c1-11(13)9-5-3-2-4-8(9)6-7-10(11)12/h2-7,13H,1H3

InChIKey

BIFHWLQPOGDRGR-UHFFFAOYSA-N

Compound name

1-hydroxy-1-methylnaphthalen-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 18
Patents: 174.06808 Da
Monoisotopic Mass: 1.5
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]+	175.07536	134.8
[M+Na]+	197.05730	149.0
[M+NH4]+	192.10190	145.8
[M+K]+	213.03124	140.1
[M-H]-	173.06080	137.6
[M+Na-2H]-	195.04275	143.4
[M]+	174.06753	137.9
[M]-	174.06863	137.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe