CID 167719707

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

Structural Information

Molecular Formula
C12H23BO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C2(CCCC2)C
InChI
InChI=1S/C12H23BO2/c1-10(2)11(3,4)15-13(14-10)12(5)8-6-7-9-12/h6-9H2,1-5H3
InChIKey
STUQZGQSZZWTLW-UHFFFAOYSA-N
Compound name
4,4,5,5-tetramethyl-2-(1-methylcyclopentyl)-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.17911 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.186386 141.6
[M+Na]+ 233.168328 149.3
[M-H]- 209.171834 149.7
[M+NH4]+ 228.212933 167.5
[M+K]+ 249.142268 150.3
[M+H-H2O]+ 193.176370 139.5
[M+HCOO]- 255.177311 160.8
[M+CH3COO]- 269.192961 185.9
[M+Na-2H]- 231.153776 146.6
[M]+ 210.17856142 142.2
[M]- 210.17965858 142.2
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.