CID 16414230

486422-08-6

Structural Information

Molecular Formula
C12H18BNO4S
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC=C2)S(=O)(=O)N
InChI
InChI=1S/C12H18BNO4S/c1-11(2)12(3,4)18-13(17-11)9-6-5-7-10(8-9)19(14,15)16/h5-8H,1-4H3,(H2,14,15,16)
InChIKey
OHKKUZJVWWPUNY-UHFFFAOYSA-N
Compound name
3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

284
Patents

283.10495 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.11223 159.3
[M+Na]+ 306.09417 169.2
[M+NH4]+ 301.13877 168.8
[M+K]+ 322.06811 162.3
[M-H]- 282.09767 163.7
[M+Na-2H]- 304.07962 166.2
[M]+ 283.10440 162.7
[M]- 283.10550 162.7
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