CID 145874387

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

Structural Information

Molecular Formula
C15H27BO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C2CC2C3CCCCC3
InChI
InChI=1S/C15H27BO2/c1-14(2)15(3,4)18-16(17-14)13-10-12(13)11-8-6-5-7-9-11/h11-13H,5-10H2,1-4H3
InChIKey
DYVCJWOYPUWVFB-UHFFFAOYSA-N
Compound name
2-(2-cyclohexylcyclopropyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

250.2104 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.217676 154.3
[M+Na]+ 273.199618 161.5
[M-H]- 249.203124 165.4
[M+NH4]+ 268.244223 170.0
[M+K]+ 289.173558 162.9
[M+H-H2O]+ 233.207660 149.8
[M+HCOO]- 295.208601 169.6
[M+CH3COO]- 309.224251 197.3
[M+Na-2H]- 271.185066 157.1
[M]+ 250.20985142 155.4
[M]- 250.21094858 155.4
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.