CID 56776925

1040281-84-2

Structural Information

Molecular Formula
C10H14BClO2S
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC(=CS2)Cl
InChI
InChI=1S/C10H14BClO2S/c1-9(2)10(3,4)14-11(13-9)8-5-7(12)6-15-8/h5-6H,1-4H3
InChIKey
FQPQQVUHQXLKDP-UHFFFAOYSA-N
Compound name
2-(4-chlorothiophen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

244.0496 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.05688 146.0
[M+Na]+ 267.03882 157.5
[M-H]- 243.04232 155.4
[M+NH4]+ 262.08342 170.6
[M+K]+ 283.01276 156.3
[M+H-H2O]+ 227.04686 144.7
[M+HCOO]- 289.04780 159.4
[M+CH3COO]- 303.06345 161.1
[M+Na-2H]- 265.02427 148.6
[M]+ 244.04905 152.9
[M]- 244.05015 152.9
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