CID 145912982

Rac-2-[(1r,2r)-2-cyclopentylcyclopropyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Structural Information

Molecular Formula
C14H25BO2
SMILES
B1(OC(C(O1)(C)C)(C)C)[C@@H]2C[C@H]2C3CCCC3
InChI
InChI=1S/C14H25BO2/c1-13(2)14(3,4)17-15(16-13)12-9-11(12)10-7-5-6-8-10/h10-12H,5-9H2,1-4H3/t11-,12+/m0/s1
InChIKey
LGNSYQUAXUXAOJ-NWDGAFQWSA-N
Compound name
2-[(1R,2R)-2-cyclopentylcyclopropyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

236.19476 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.20204 147.7
[M+Na]+ 259.18398 156.1
[M-H]- 235.18748 159.3
[M+NH4]+ 254.22858 165.7
[M+K]+ 275.15792 157.0
[M+H-H2O]+ 219.19202 144.7
[M+HCOO]- 281.19296 165.2
[M+CH3COO]- 295.20861 194.4
[M+Na-2H]- 257.16943 150.2
[M]+ 236.19421 150.6
[M]- 236.19531 150.6
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.