CID 45790008

1264198-70-0

Structural Information

Molecular Formula
C11H21BO2S
SMILES
B1(OC(C(O1)(C)C)(C)C)C2CCSCC2
InChI
InChI=1S/C11H21BO2S/c1-10(2)11(3,4)14-12(13-10)9-5-7-15-8-6-9/h9H,5-8H2,1-4H3
InChIKey
BMKXTGYFWUOVQI-UHFFFAOYSA-N
Compound name
4,4,5,5-tetramethyl-2-(thian-4-yl)-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

228.13553 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.14281 146.9
[M+Na]+ 251.12475 153.4
[M-H]- 227.12825 154.5
[M+NH4]+ 246.16935 169.0
[M+K]+ 267.09869 154.4
[M+H-H2O]+ 211.13279 143.4
[M+HCOO]- 273.13373 159.5
[M+CH3COO]- 287.14938 186.7
[M+Na-2H]- 249.11020 149.6
[M]+ 228.13498 147.0
[M]- 228.13608 147.0
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.