CID 12258664

59336-52-6

Structural Information

Molecular Formula

C₁₀H₁₂N₂O

SMILES

CC(C)(C1=NC2=CC=CC=C2N1)O

InChI

InChI=1S/C10H12N2O/c1-10(2,13)9-11-7-5-3-4-6-8(7)12-9/h3-6,13H,1-2H3,(H,11,12)

InChIKey

GRQAHHVRIFRTRC-UHFFFAOYSA-N

Compound name

2-(1H-benzimidazol-2-yl)propan-2-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 7
Patents: 176.09496 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]+	177.10224	138.1
[M+Na]+	199.08418	148.1
[M-H]-	175.08768	138.1
[M+NH4]+	194.12878	157.6
[M+K]+	215.05812	144.0
[M+H-H2O]+	159.09222	132.2
[M+HCOO]-	221.09316	157.4
[M+CH3COO]-	235.10881	175.1
[M+Na-2H]-	197.06963	146.4
[M]+	176.09441	138.0
[M]-	176.09551	138.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe