CID 84820109

1370535-33-3

Structural Information

Molecular Formula
C11H19BO4S
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CCS(=O)(=O)CC2
InChI
InChI=1S/C11H19BO4S/c1-10(2)11(3,4)16-12(15-10)9-5-7-17(13,14)8-6-9/h5H,6-8H2,1-4H3
InChIKey
ALXDCUFWZWEIFD-UHFFFAOYSA-N
Compound name
4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-thiopyran 1,1-dioxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

44
Patents

258.1097 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.11698 151.6
[M+Na]+ 281.09892 161.7
[M+NH4]+ 276.14352 163.4
[M+K]+ 297.07286 152.2
[M-H]- 257.10242 156.2
[M+Na-2H]- 279.08437 159.4
[M]+ 258.10915 155.3
[M]- 258.11025 155.3
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