CID 16217721

796061-08-0

Structural Information

Molecular Formula
C19H24BNO4S
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)C
InChI
InChI=1S/C19H24BNO4S/c1-14-9-11-17(12-10-14)26(22,23)21-16-8-6-7-15(13-16)20-24-18(2,3)19(4,5)25-20/h6-13,21H,1-5H3
InChIKey
RGAZOXRZFCGICF-UHFFFAOYSA-N
Compound name
4-methyl-N-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

36
Patents

373.15192 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.15920 182.7
[M+Na]+ 396.14114 194.7
[M+NH4]+ 391.18574 192.4
[M+K]+ 412.11508 185.8
[M-H]- 372.14464 189.9
[M+Na-2H]- 394.12659 192.3
[M]+ 373.15137 187.4
[M]- 373.15247 187.4
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