CID 121553466

2-(3,5-dimethylcyclohexyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Structural Information

Molecular Formula
C14H27BO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C2CC(CC(C2)C)C
InChI
InChI=1S/C14H27BO2/c1-10-7-11(2)9-12(8-10)15-16-13(3,4)14(5,6)17-15/h10-12H,7-9H2,1-6H3
InChIKey
LNPLDQWYKSXELH-UHFFFAOYSA-N
Compound name
2-(3,5-dimethylcyclohexyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.2104 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.21768 154.7
[M+Na]+ 261.19962 165.4
[M+NH4]+ 256.24422 166.2
[M+K]+ 277.17356 158.1
[M-H]- 237.20312 160.7
[M+Na-2H]- 259.18507 160.5
[M]+ 238.20985 158.3
[M]- 238.21095 158.3
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

No patent data available for this compound.