CID 97070

2-benzoylfluorene

Structural Information

Molecular Formula
C20H14O
SMILES
C1C2=CC=CC=C2C3=C1C=C(C=C3)C(=O)C4=CC=CC=C4
InChI
InChI=1S/C20H14O/c21-20(14-6-2-1-3-7-14)16-10-11-19-17(13-16)12-15-8-4-5-9-18(15)19/h1-11,13H,12H2
InChIKey
CVTOUHCXGZGKEI-UHFFFAOYSA-N
Compound name
9H-fluoren-2-yl(phenyl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

4
Patents

270.10446 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.11174 162.4
[M+Na]+ 293.09368 170.8
[M-H]- 269.09718 171.1
[M+NH4]+ 288.13828 182.1
[M+K]+ 309.06762 164.6
[M+H-H2O]+ 253.10172 154.8
[M+HCOO]- 315.10266 184.4
[M+CH3COO]- 329.11831 174.9
[M+Na-2H]- 291.07913 167.5
[M]+ 270.10391 162.5
[M]- 270.10501 162.5
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