CID 8289

Triphenyl phosphate

Structural Information

Molecular Formula
C18H15O4P
SMILES
C1=CC=C(C=C1)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3
InChI
InChI=1S/C18H15O4P/c19-23(20-16-10-4-1-5-11-16,21-17-12-6-2-7-13-17)22-18-14-8-3-9-15-18/h1-15H
InChIKey
XZZNDPSIHUTMOC-UHFFFAOYSA-N
Compound name
triphenyl phosphate
Related CIDs

2D Structure

compound 2d structure
8
Annotation Hits

449
References

129083
Patents

326.0708 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.078076 175.2
[M+Na]+ 349.060018 180.7
[M-H]- 325.063524 183.2
[M+NH4]+ 344.104623 188.2
[M+K]+ 365.033958 177.6
[M+H-H2O]+ 309.068060 163.3
[M+HCOO]- 371.069001 203.5
[M+CH3COO]- 385.084651 204.9
[M+Na-2H]- 347.045466 179.9
[M]+ 326.07025142 177.8
[M]- 326.07134858 177.8
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