CID 186199

1,10b-dihydrofluoranthene

Structural Information

Molecular Formula
C16H12
SMILES
C1C=CC2=C3C1C4=CC=CC=C4C3=CC=C2
InChI
InChI=1S/C16H12/c1-2-8-13-12(7-1)14-9-3-5-11-6-4-10-15(13)16(11)14/h1-9,15H,10H2
InChIKey
BRAFGYUTFFBQFH-UHFFFAOYSA-N
Compound name
1,10b-dihydrofluoranthene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

204.0939 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.101176 142.7
[M+Na]+ 227.083118 152.0
[M-H]- 203.086624 148.6
[M+NH4]+ 222.127723 167.0
[M+K]+ 243.057058 146.3
[M+H-H2O]+ 187.091160 136.4
[M+HCOO]- 249.092101 163.8
[M+CH3COO]- 263.107751 156.4
[M+Na-2H]- 225.068566 151.3
[M]+ 204.09335142 143.1
[M]- 204.09444858 143.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe