CID 20734

2,3-dimethylfluorene

Structural Information

Molecular Formula

C₁₅H₁₄

SMILES

CC1=CC2=C(C=C1C)C3=CC=CC=C3C2

InChI

InChI=1S/C15H14/c1-10-7-13-9-12-5-3-4-6-14(12)15(13)8-11(10)2/h3-8H,9H2,1-2H3

InChIKey

WZKBKKCKPZMGHV-UHFFFAOYSA-N

Compound name

2,3-dimethyl-9H-fluorene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3094
Patents: 194.10954 Da
Monoisotopic Mass: 4.9
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]+	195.116816	141.8
[M+Na]+	217.098758	152.3
[M-H]-	193.102264	148.0
[M+NH4]+	212.143363	166.0
[M+K]+	233.072698	147.4
[M+H-H2O]+	177.106800	136.4
[M+HCOO]-	239.107741	164.9
[M+CH3COO]-	253.123391	156.4
[M+Na-2H]-	215.084206	148.2
[M]+	194.10899142	143.2
[M]-	194.11008858	143.2

Literature stripe

literature stripe

Patent stripe

patents stripe