CID 66715127

1003298-87-0

Structural Information

Molecular Formula
C12H15BCl2O3
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(C(=C2)Cl)O)Cl
InChI
InChI=1S/C12H15BCl2O3/c1-11(2)12(3,4)18-13(17-11)7-5-8(14)10(16)9(15)6-7/h5-6,16H,1-4H3
InChIKey
IAVSUBSFIDLDNW-UHFFFAOYSA-N
Compound name
2,6-dichloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
Patents

288.04913 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.05641 154.9
[M+Na]+ 311.03835 169.3
[M+NH4]+ 306.08295 166.1
[M+K]+ 327.01229 161.5
[M-H]- 287.04185 160.3
[M+Na-2H]- 309.02380 162.7
[M]+ 288.04858 159.5
[M]- 288.04968 159.5
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