CID 68997

9-phenylxanthen-9-ol

Structural Information

Molecular Formula
C19H14O2
SMILES
C1=CC=C(C=C1)C2(C3=CC=CC=C3OC4=CC=CC=C42)O
InChI
InChI=1S/C19H14O2/c20-19(14-8-2-1-3-9-14)15-10-4-6-12-17(15)21-18-13-7-5-11-16(18)19/h1-13,20H
InChIKey
CVZUPKFPOSRRSK-UHFFFAOYSA-N
Compound name
9-phenylxanthen-9-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

482
Patents

274.09937 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.10665 162.1
[M+Na]+ 297.08859 171.0
[M-H]- 273.09209 170.1
[M+NH4]+ 292.13319 179.9
[M+K]+ 313.06253 166.3
[M+H-H2O]+ 257.09663 153.5
[M+HCOO]- 319.09757 180.8
[M+CH3COO]- 333.11322 174.2
[M+Na-2H]- 295.07404 172.1
[M]+ 274.09882 161.5
[M]- 274.09992 161.5
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