CID 72207120

2121511-82-6

Structural Information

Molecular Formula
C11H17BO3S
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=C(SC=C2)CO
InChI
InChI=1S/C11H17BO3S/c1-10(2)11(3,4)15-12(14-10)8-5-6-16-9(8)7-13/h5-6,13H,7H2,1-4H3
InChIKey
IUICGXJAVAVYQQ-UHFFFAOYSA-N
Compound name
[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophen-2-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.09915 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.10643 149.7
[M+Na]+ 263.08837 159.6
[M+NH4]+ 258.13297 160.7
[M+K]+ 279.06231 153.4
[M-H]- 239.09187 154.3
[M+Na-2H]- 261.07382 155.5
[M]+ 240.09860 153.2
[M]- 240.09970 153.2
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.