CID 146155738

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

Structural Information

Molecular Formula
C11H21BO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C2[C@@H]([C@H]2C)C
InChI
InChI=1S/C11H21BO2/c1-7-8(2)9(7)12-13-10(3,4)11(5,6)14-12/h7-9H,1-6H3/t7-,8-/m1/s1
InChIKey
SZJUFKBENNWZRD-HTQZYQBOSA-N
Compound name
2-[(2S,3S)-2,3-dimethylcyclopropyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

196.16347 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.17075 137.2
[M+Na]+ 219.15269 148.4
[M-H]- 195.15619 147.1
[M+NH4]+ 214.19729 156.0
[M+K]+ 235.12663 150.0
[M+H-H2O]+ 179.16073 134.6
[M+HCOO]- 241.16167 156.3
[M+CH3COO]- 255.17732 190.2
[M+Na-2H]- 217.13814 142.8
[M]+ 196.16292 144.0
[M]- 196.16402 144.0
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.