CID 137963825

4,4,5,5-tetramethyl-2-{spiro[2.3]hexan-1-yl}-1,3,2-dioxaborolane

Structural Information

Molecular Formula
C12H21BO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C2CC23CCC3
InChI
InChI=1S/C12H21BO2/c1-10(2)11(3,4)15-13(14-10)9-8-12(9)6-5-7-12/h9H,5-8H2,1-4H3
InChIKey
AXCHXUZGLKMGFL-UHFFFAOYSA-N
Compound name
4,4,5,5-tetramethyl-2-spiro[2.3]hexan-2-yl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.16347 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.17075 137.7
[M+Na]+ 231.15269 146.3
[M-H]- 207.15619 149.0
[M+NH4]+ 226.19729 151.4
[M+K]+ 247.12663 151.0
[M+H-H2O]+ 191.16073 132.0
[M+HCOO]- 253.16167 154.6
[M+CH3COO]- 267.17732 192.4
[M+Na-2H]- 229.13814 144.9
[M]+ 208.16292 150.4
[M]- 208.16402 150.4
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.