CID 96998

1,4-dimethyl-9h-carbazole

Structural Information

Molecular Formula

C₁₄H₁₃N

SMILES

CC1=C2C3=CC=CC=C3NC2=C(C=C1)C

InChI

InChI=1S/C14H13N/c1-9-7-8-10(2)14-13(9)11-5-3-4-6-12(11)15-14/h3-8,15H,1-2H3

InChIKey

APYQRKDHRDGCBK-UHFFFAOYSA-N

Compound name

1,4-dimethyl-9H-carbazole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 7
References: 62
Patents: 195.1048 Da
Monoisotopic Mass: 4.1
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]+	196.112076	141.4
[M+Na]+	218.094018	153.1
[M-H]-	194.097524	145.4
[M+NH4]+	213.138623	163.6
[M+K]+	234.067958	147.2
[M+H-H2O]+	178.102060	135.5
[M+HCOO]-	240.103001	163.5
[M+CH3COO]-	254.118651	155.6
[M+Na-2H]-	216.079466	148.9
[M]+	195.10425142	142.8
[M]-	195.10534858	142.8

Literature stripe

literature stripe

Patent stripe

patents stripe