CID 85529707

(3-bromophenyl)diphenylphosphine oxide

Structural Information

Molecular Formula
C18H14BrOP
SMILES
C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)C3=CC(=CC=C3)Br
InChI
InChI=1S/C18H14BrOP/c19-15-8-7-13-18(14-15)21(20,16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-14H
InChIKey
GZZLAPUQZCXKKT-UHFFFAOYSA-N
Compound name
1-bromo-3-diphenylphosphorylbenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

185
Patents

355.99655 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.00383 170.5
[M+Na]+ 378.98577 177.2
[M+NH4]+ 374.03037 176.1
[M+K]+ 394.95971 174.5
[M-H]- 354.98927 175.3
[M+Na-2H]- 376.97122 179.2
[M]+ 355.99600 172.0
[M]- 355.99710 172.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe