CID 83329

Boron phosphate

Structural Information

Molecular Formula
BO4P
SMILES
B12OP(=O)(O1)O2
InChI
InChI=1S/BO4P/c2-6-3-1(4-6)5-6
InChIKey
RKVCQBPDVHFKCU-UHFFFAOYSA-N
Compound name
2,4,5-trioxa-1lambda5-phospha-3-borabicyclo[1.1.1]pentane 1-oxide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

70
Patents

105.96272 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 106.969996 112.8
[M+Na]+ 128.951938 117.7
[M-H]- 104.955444 117.2
[M+NH4]+ 123.996543 117.5
[M+K]+ 144.925878 128.9
[M+H-H2O]+ 88.959980 99.0
[M+HCOO]- 150.960921 130.8
[M+CH3COO]- 164.976571 196.8
[M+Na-2H]- 126.937386 123.6
[M]+ 105.96217142 141.3
[M]- 105.96326858 141.3
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