CID 224094

2-iodo-9h-fluorene

Structural Information

Molecular Formula
C13H9I
SMILES
C1C2=CC=CC=C2C3=C1C=C(C=C3)I
InChI
InChI=1S/C13H9I/c14-11-5-6-13-10(8-11)7-9-3-1-2-4-12(9)13/h1-6,8H,7H2
InChIKey
VNYQUOAQPXGXQO-UHFFFAOYSA-N
Compound name
2-iodo-9H-fluorene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

228
Patents

291.9749 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.98218 138.6
[M+Na]+ 314.96412 141.7
[M-H]- 290.96762 137.2
[M+NH4]+ 310.00872 157.5
[M+K]+ 330.93806 142.9
[M+H-H2O]+ 274.97216 129.6
[M+HCOO]- 336.97310 157.2
[M+CH3COO]- 350.98875 149.0
[M+Na-2H]- 312.94957 135.1
[M]+ 291.97435 136.4
[M]- 291.97545 136.4
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