CID 13282

Diphenyl phosphate

Structural Information

Molecular Formula
C12H11O4P
SMILES
C1=CC=C(C=C1)OP(=O)(O)OC2=CC=CC=C2
InChI
InChI=1S/C12H11O4P/c13-17(14,15-11-7-3-1-4-8-11)16-12-9-5-2-6-10-12/h1-10H,(H,13,14)
InChIKey
ASMQGLCHMVWBQR-UHFFFAOYSA-N
Compound name
diphenyl hydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

32
References

27669
Patents

250.03949 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.04677 154.1
[M+Na]+ 273.02871 160.7
[M-H]- 249.03221 158.3
[M+NH4]+ 268.07331 170.3
[M+K]+ 289.00265 158.5
[M+H-H2O]+ 233.03675 144.6
[M+HCOO]- 295.03769 182.0
[M+CH3COO]- 309.05334 188.2
[M+Na-2H]- 271.01416 159.4
[M]+ 250.03894 156.1
[M]- 250.04004 156.1
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

No patent data available for this compound.