CID 2773615

2-butyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Structural Information

Molecular Formula
C10H21BO2
SMILES
B1(OC(C(O1)(C)C)(C)C)CCCC
InChI
InChI=1S/C10H21BO2/c1-6-7-8-11-12-9(2,3)10(4,5)13-11/h6-8H2,1-5H3
InChIKey
ZHBANXSNVFDSMK-UHFFFAOYSA-N
Compound name
2-butyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

65
Patents

184.16347 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.170746 136.8
[M+Na]+ 207.152688 145.1
[M-H]- 183.156194 141.9
[M+NH4]+ 202.197293 160.5
[M+K]+ 223.126628 146.7
[M+H-H2O]+ 167.160730 134.2
[M+HCOO]- 229.161671 157.2
[M+CH3COO]- 243.177321 183.3
[M+Na-2H]- 205.138136 143.6
[M]+ 184.16292142 140.8
[M]- 184.16401858 140.8
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

patents stripe