CID 15260005

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

Structural Information

Molecular Formula
C12H23BO2
SMILES
B1(OC(C(O1)(C)C)(C)C)CC2CCCC2
InChI
InChI=1S/C12H23BO2/c1-11(2)12(3,4)15-13(14-11)9-10-7-5-6-8-10/h10H,5-9H2,1-4H3
InChIKey
TZYFVFXOXYSETL-UHFFFAOYSA-N
Compound name
2-(cyclopentylmethyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

210.17911 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.18639 145.5
[M+Na]+ 233.16833 152.2
[M-H]- 209.17183 153.1
[M+NH4]+ 228.21293 169.3
[M+K]+ 249.14227 152.9
[M+H-H2O]+ 193.17637 142.5
[M+HCOO]- 255.17731 164.6
[M+CH3COO]- 269.19296 185.9
[M+Na-2H]- 231.15378 148.8
[M]+ 210.17856 145.5
[M]- 210.17966 145.5
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.