CID 518682

Boron trioxide

Structural Information

Molecular Formula
B2O3
SMILES
B(=O)OB=O
InChI
InChI=1S/B2O3/c3-1-5-2-4
InChIKey
JKWMSGQKBLHBQQ-UHFFFAOYSA-N
Compound name
oxo(oxoboranyloxy)borane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

100593
Patents

70.00336 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 71.010636 101.8
[M+Na]+ 92.992578 111.4
[M-H]- 68.996084 102.9
[M+NH4]+ 88.037183 126.3
[M+K]+ 108.96652 112.7
[M+H-H2O]+ 53.000620 98.1
[M+HCOO]- 115.00156 128.3
[M+CH3COO]- 129.01721 157.9
[M+Na-2H]- 90.978026 111.7
[M]+ 70.002811 104.5
[M]- 70.003909 104.5
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