CID 10925911

105937-68-6

Structural Information

Molecular Formula
C18H15O5P
SMILES
C1=CC=C(C=C1)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC(=C3)O
InChI
InChI=1S/C18H15O5P/c19-15-8-7-13-18(14-15)23-24(20,21-16-9-3-1-4-10-16)22-17-11-5-2-6-12-17/h1-14,19H
InChIKey
AWYVETCHVQGXMB-UHFFFAOYSA-N
Compound name
(3-hydroxyphenyl) diphenyl phosphate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

1521
Patents

342.0657 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.07298 177.9
[M+Na]+ 365.05492 183.6
[M-H]- 341.05842 184.9
[M+NH4]+ 360.09952 189.7
[M+K]+ 381.02886 180.6
[M+H-H2O]+ 325.06296 166.1
[M+HCOO]- 387.06390 204.9
[M+CH3COO]- 401.07955 205.7
[M+Na-2H]- 363.04037 181.8
[M]+ 342.06515 180.5
[M]- 342.06625 180.5
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