CID 139958

Hexafluorocyclotriphosphazene

Structural Information

Molecular Formula
F6N3P3
SMILES
N1=P(N=P(N=P1(F)F)(F)F)(F)F
InChI
InChI=1S/F6N3P3/c1-10(2)7-11(3,4)9-12(5,6)8-10
InChIKey
DKQPXAWBVGCNHG-UHFFFAOYSA-N
Compound name
2,2,4,4,6,6-hexafluoro-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-triene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

631
Patents

248.92093 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.92821 131.9
[M+Na]+ 271.91015 145.2
[M-H]- 247.91365 122.7
[M+NH4]+ 266.95475 152.2
[M+K]+ 287.88409 143.9
[M+H-H2O]+ 231.91819 115.2
[M+HCOO]- 293.91913 163.2
[M+CH3COO]- 307.93478 193.2
[M+Na-2H]- 269.89560 133.6
[M]+ 248.92038 128.7
[M]- 248.92148 128.7
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