CID 3262261

73500-82-0

Structural Information

Molecular Formula

C₁₃H₈ClNO

SMILES

C1=CC=C2C(=C1)C3=CC=CC=C3N2C(=O)Cl

InChI

InChI=1S/C13H8ClNO/c14-13(16)15-11-7-3-1-5-9(11)10-6-2-4-8-12(10)15/h1-8H

InChIKey

RCENRFKQKSIRLA-UHFFFAOYSA-N

Compound name

carbazole-9-carbonyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 231
Patents: 229.02943 Da
Monoisotopic Mass: 4.3
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]+	230.03671	145.1
[M+Na]+	252.01865	161.9
[M+NH4]+	247.06325	155.6
[M+K]+	267.99259	154.8
[M-H]-	228.02215	148.5
[M+Na-2H]-	250.00410	153.1
[M]+	229.02888	149.0
[M]-	229.02998	149.0

Literature stripe

literature stripe

Patent stripe

patents stripe