CID 121553175

(3-methoxy-1,2-thiazol-5-yl)boronic acid

Structural Information

Molecular Formula
C4H6BNO3S
SMILES
B(C1=CC(=NS1)OC)(O)O
InChI
InChI=1S/C4H6BNO3S/c1-9-4-2-3(5(7)8)10-6-4/h2,7-8H,1H3
InChIKey
CNKSRAACQREZFL-UHFFFAOYSA-N
Compound name
(3-methoxy-1,2-thiazol-5-yl)boronic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

159.01614 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.02342 129.8
[M+Na]+ 182.00536 139.2
[M+NH4]+ 177.04996 137.3
[M+K]+ 197.97930 135.7
[M-H]- 158.00886 129.0
[M+Na-2H]- 179.99081 133.0
[M]+ 159.01559 131.0
[M]- 159.01669 131.0
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

No patent data available for this compound.