CID 49760452

1257641-28-3

Structural Information

Molecular Formula
C11H14BCl2NO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=C(C=NC=C2Cl)Cl
InChI
InChI=1S/C11H14BCl2NO2/c1-10(2)11(3,4)17-12(16-10)9-7(13)5-15-6-8(9)14/h5-6H,1-4H3
InChIKey
RGVJCGWAHPEENO-UHFFFAOYSA-N
Compound name
3,5-dichloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

273.04947 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.05675 152.3
[M+Na]+ 296.03869 167.3
[M+NH4]+ 291.08329 163.7
[M+K]+ 312.01263 159.0
[M-H]- 272.04219 157.8
[M+Na-2H]- 294.02414 160.9
[M]+ 273.04892 157.1
[M]- 273.05002 157.1
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.