CID 59755199

947165-26-6

Structural Information

Molecular Formula
C7H8BNO2
SMILES
B1(C2=C(CO1)C=C(C=C2)N)O
InChI
InChI=1S/C7H8BNO2/c9-6-1-2-7-5(3-6)4-11-8(7)10/h1-3,10H,4,9H2
InChIKey
SBHOFSMRVTYWOW-UHFFFAOYSA-N
Compound name
1-hydroxy-3H-2,1-benzoxaborol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

149.0648 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.07208 126.4
[M+Na]+ 172.05402 137.7
[M+NH4]+ 167.09862 135.5
[M+K]+ 188.02796 134.6
[M-H]- 148.05752 129.8
[M+Na-2H]- 170.03947 131.0
[M]+ 149.06425 128.8
[M]- 149.06535 128.8
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