CID 796918

70127-50-3

Structural Information

Molecular Formula
C19H17O2P
SMILES
C1=CC=C(C=C1)P(=O)(CC2=CC=CC=C2O)C3=CC=CC=C3
InChI
InChI=1S/C19H17O2P/c20-19-14-8-7-9-16(19)15-22(21,17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-14,20H,15H2
InChIKey
NQWHOPCJTGVYOX-UHFFFAOYSA-N
Compound name
2-(diphenylphosphorylmethyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

49
Patents

308.09662 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.10390 174.3
[M+Na]+ 331.08584 180.2
[M-H]- 307.08934 181.1
[M+NH4]+ 326.13044 187.9
[M+K]+ 347.05978 174.7
[M+H-H2O]+ 291.09388 163.2
[M+HCOO]- 353.09482 200.4
[M+CH3COO]- 367.11047 202.3
[M+Na-2H]- 329.07129 177.0
[M]+ 308.09607 173.1
[M]- 308.09717 173.1
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