CID 89305

1,2,3,10b-tetrahydrofluoranthene

Structural Information

Molecular Formula
C16H14
SMILES
C1CC2C3=CC=CC=C3C4=CC=CC(=C24)C1
InChI
InChI=1S/C16H14/c1-2-8-13-12(7-1)14-9-3-5-11-6-4-10-15(13)16(11)14/h1-3,5,7-9,15H,4,6,10H2
InChIKey
VMBZUGDYWLFLEU-UHFFFAOYSA-N
Compound name
1,2,3,10b-tetrahydrofluoranthene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

206.10954 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.116816 143.9
[M+Na]+ 229.098758 152.1
[M-H]- 205.102264 149.3
[M+NH4]+ 224.143363 168.0
[M+K]+ 245.072698 146.5
[M+H-H2O]+ 189.106800 137.5
[M+HCOO]- 251.107741 163.5
[M+CH3COO]- 265.123391 157.0
[M+Na-2H]- 227.084206 151.4
[M]+ 206.10899142 142.8
[M]- 206.11008858 142.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe