CID 9154

Fluoranthene

Structural Information

Molecular Formula

C₁₆H₁₀

SMILES

C1=CC=C2C(=C1)C3=CC=CC4=C3C2=CC=C4

InChI

InChI=1S/C16H10/c1-2-8-13-12(7-1)14-9-3-5-11-6-4-10-15(13)16(11)14/h1-10H

InChIKey

GVEPBJHOBDJJJI-UHFFFAOYSA-N

Compound name

fluoranthene

Related CIDs

2D Structure

compound 2d structure

6
Annotation Hits: 1272
References: 26256
Patents: 202.07825 Da
Monoisotopic Mass: 5.2
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]+	203.08553	141.3
[M+Na]+	225.06747	158.7
[M+NH4]+	220.11207	154.2
[M+K]+	241.04141	150.0
[M-H]-	201.07097	146.9
[M+Na-2H]-	223.05292	149.9
[M]+	202.07770	145.8
[M]-	202.07880	145.8

Literature stripe

literature stripe

Patent stripe

patents stripe