CID 4145301

93335-38-7

Structural Information

Molecular Formula

C₁₀H₁₁ClN₂O

SMILES

C1CN=C(N1)C(C2=CC=C(C=C2)Cl)O

InChI

InChI=1S/C10H11ClN2O/c11-8-3-1-7(2-4-8)9(14)10-12-5-6-13-10/h1-4,9,14H,5-6H2,(H,12,13)

InChIKey

KLOAJGDBVFVYMH-UHFFFAOYSA-N

Compound name

(4-chlorophenyl)-(4,5-dihydro-1H-imidazol-2-yl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 210.05598 Da
Monoisotopic Mass: 0.9
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]+	211.063256	144.0
[M+Na]+	233.045198	151.7
[M-H]-	209.048704	145.1
[M+NH4]+	228.089803	161.0
[M+K]+	249.019138	146.3
[M+H-H2O]+	193.053240	136.9
[M+HCOO]-	255.054181	157.9
[M+CH3COO]-	269.069831	155.4
[M+Na-2H]-	231.030646	147.2
[M]+	210.05543142	141.4
[M]-	210.05652858	141.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe