CID 11171482

155884-01-8

Structural Information

Molecular Formula
C7H7BN4O2
SMILES
B(C1=CC=CC=C1C2=NNN=N2)(O)O
InChI
InChI=1S/C7H7BN4O2/c13-8(14)6-4-2-1-3-5(6)7-9-11-12-10-7/h1-4,13-14H,(H,9,10,11,12)
InChIKey
GVRXWYFECKHTSJ-UHFFFAOYSA-N
Compound name
[2-(2H-tetrazol-5-yl)phenyl]boronic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

197
Patents

190.06621 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.07349 138.7
[M+Na]+ 213.05543 150.3
[M+NH4]+ 208.10003 144.3
[M+K]+ 229.02937 148.5
[M-H]- 189.05893 137.9
[M+Na-2H]- 211.04088 144.9
[M]+ 190.06566 139.7
[M]- 190.06676 139.7
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