CID 238623

4-phenoxybenzophenone

Structural Information

Molecular Formula
C19H14O2
SMILES
C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OC3=CC=CC=C3
InChI
InChI=1S/C19H14O2/c20-19(15-7-3-1-4-8-15)16-11-13-18(14-12-16)21-17-9-5-2-6-10-17/h1-14H
InChIKey
ITVUPWDTDWMACZ-UHFFFAOYSA-N
Compound name
(4-phenoxyphenyl)-phenylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

854
Patents

274.09937 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.10665 162.9
[M+Na]+ 297.08859 169.4
[M-H]- 273.09209 172.3
[M+NH4]+ 292.13319 177.9
[M+K]+ 313.06253 164.7
[M+H-H2O]+ 257.09663 153.8
[M+HCOO]- 319.09757 186.4
[M+CH3COO]- 333.11322 174.8
[M+Na-2H]- 295.07404 168.7
[M]+ 274.09882 162.7
[M]- 274.09992 162.7
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