CID 66521363

2223048-10-8

Structural Information

Molecular Formula
C9H13BFNO2S
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CN=C(S2)F
InChI
InChI=1S/C9H13BFNO2S/c1-8(2)9(3,4)14-10(13-8)6-5-12-7(11)15-6/h5H,1-4H3
InChIKey
UUHWEZOKSHALAX-UHFFFAOYSA-N
Compound name
2-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

229.0744 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.08168 139.5
[M+Na]+ 252.06362 151.0
[M-H]- 228.06712 146.3
[M+NH4]+ 247.10822 162.6
[M+K]+ 268.03756 151.5
[M+H-H2O]+ 212.07166 135.9
[M+HCOO]- 274.07260 155.7
[M+CH3COO]- 288.08825 186.4
[M+Na-2H]- 250.04907 142.2
[M]+ 229.07385 144.0
[M]- 229.07495 144.0
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.