CID 165735511

2815327-64-9

Structural Information

Molecular Formula
C15H19BO3S
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=C(C3=C(C=C2)SC=C3)OC
InChI
InChI=1S/C15H19BO3S/c1-14(2)15(3,4)19-16(18-14)11-6-7-12-10(8-9-20-12)13(11)17-5/h6-9H,1-5H3
InChIKey
XSCJRRUWVRTYIP-UHFFFAOYSA-N
Compound name
2-(4-methoxy-1-benzothiophen-5-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.1148 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.12208 160.7
[M+Na]+ 313.10402 173.7
[M+NH4]+ 308.14862 172.9
[M+K]+ 329.07796 165.7
[M-H]- 289.10752 167.2
[M+Na-2H]- 311.08947 168.2
[M]+ 290.11425 165.5
[M]- 290.11535 165.5
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.