CID 5289333

1,3,2-dioxaborolan-2-ol

Structural Information

Molecular Formula
C2H5BO3
SMILES
B1(OCCO1)O
InChI
InChI=1S/C2H5BO3/c4-3-5-1-2-6-3/h4H,1-2H2
InChIKey
ZBEDLGKSWBORBS-UHFFFAOYSA-N
Compound name
2-hydroxy-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

79
Patents

88.03317 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 89.040446 110.1
[M+Na]+ 111.02239 117.4
[M-H]- 87.025894 113.5
[M+NH4]+ 106.06699 132.0
[M+K]+ 126.99633 120.1
[M+H-H2O]+ 71.030430 106.1
[M+HCOO]- 133.03137 131.7
[M+CH3COO]- 147.04702 156.8
[M+Na-2H]- 109.00784 119.0
[M]+ 88.032621 109.2
[M]- 88.033719 109.2
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