CID 4155765

5833-88-5

Structural Information

Molecular Formula

C₁₂H₈ClNO

SMILES

C1=CC=C2C(=C1)C3=CC(=C(C=C3O2)N)Cl

InChI

InChI=1S/C12H8ClNO/c13-9-5-8-7-3-1-2-4-11(7)15-12(8)6-10(9)14/h1-6H,14H2

InChIKey

WBIXAQXWIPSKLF-UHFFFAOYSA-N

Compound name

2-chlorodibenzofuran-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 12
Patents: 217.02943 Da
Monoisotopic Mass: 3.6
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]+	218.03671	141.1
[M+Na]+	240.01865	157.7
[M+NH4]+	235.06325	152.2
[M+K]+	255.99259	151.0
[M-H]-	216.02215	147.2
[M+Na-2H]-	238.00410	148.8
[M]+	217.02888	145.7
[M]-	217.02998	145.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe