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

1
Patents

210.17911 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.18639 146.9
[M+Na]+ 233.16833 156.1
[M+NH4]+ 228.21293 158.4
[M+K]+ 249.14227 151.0
[M-H]- 209.17183 152.0
[M+Na-2H]- 231.15378 152.6
[M]+ 210.17856 149.9
[M]- 210.17966 149.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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