CID 21115590

Schembl4342818

Structural Information

Molecular Formula
C18H5F10O3P
SMILES
C1=CC=C(C=C1)OP(OC2=C(C(=C(C(=C2F)F)F)F)F)OC3=C(C(=C(C(=C3F)F)F)F)F
InChI
InChI=1S/C18H5F10O3P/c19-7-9(21)13(25)17(14(26)10(7)22)30-32(29-6-4-2-1-3-5-6)31-18-15(27)11(23)8(20)12(24)16(18)28/h1-5H
InChIKey
NIXDKPKOZYHAIG-UHFFFAOYSA-N
Compound name
bis(2,3,4,5,6-pentafluorophenyl) phenyl phosphite
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

489.98166 Da
Monoisotopic Mass

6.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 490.98894 205.0
[M+Na]+ 512.97088 219.1
[M-H]- 488.97438 202.8
[M+NH4]+ 508.01548 213.2
[M+K]+ 528.94482 211.9
[M+H-H2O]+ 472.97892 184.9
[M+HCOO]- 534.97986 221.9
[M+CH3COO]- 548.99551 242.6
[M+Na-2H]- 510.95633 194.4
[M]+ 489.98111 199.5
[M]- 489.98221 199.5
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