CID 135705205

868260-15-5

Structural Information

Molecular Formula

C₁₀H₁₂N₂O

SMILES

CC1CN=C(N1)C2=CC=C(C=C2)O

InChI

InChI=1S/C10H12N2O/c1-7-6-11-10(12-7)8-2-4-9(13)5-3-8/h2-5,7,13H,6H2,1H3,(H,11,12)

InChIKey

PMBQYJGSKZZJKC-UHFFFAOYSA-N

Compound name

4-(5-methyl-4,5-dihydro-1H-imidazol-2-yl)phenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 25
Patents: 176.09496 Da
Monoisotopic Mass: 1.0
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]+	177.10224	137.6
[M+Na]+	199.08418	146.0
[M-H]-	175.08768	139.4
[M+NH4]+	194.12878	155.7
[M+K]+	215.05812	141.9
[M+H-H2O]+	159.09222	130.5
[M+HCOO]-	221.09316	157.3
[M+CH3COO]-	235.10881	150.1
[M+Na-2H]-	197.06963	141.9
[M]+	176.09441	134.2
[M]-	176.09551	134.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe