CID 15352670

230299-46-4

Structural Information

Molecular Formula
C14H28B2O4
SMILES
B1(OC(CC(O1)(C)C)(C)C)B2OC(CC(O2)(C)C)(C)C
InChI
InChI=1S/C14H28B2O4/c1-11(2)9-12(3,4)18-15(17-11)16-19-13(5,6)10-14(7,8)20-16/h9-10H2,1-8H3
InChIKey
CZLUUPDJUFXXHF-UHFFFAOYSA-N
Compound name
4,4,6,6-tetramethyl-2-(4,4,6,6-tetramethyl-1,3,2-dioxaborinan-2-yl)-1,3,2-dioxaborinane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

94
Patents

282.21738 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.22466 154.2
[M+Na]+ 305.20660 162.0
[M-H]- 281.21010 163.7
[M+NH4]+ 300.25120 173.4
[M+K]+ 321.18054 167.0
[M+H-H2O]+ 265.21464 150.9
[M+HCOO]- 327.21558 166.6
[M+CH3COO]- 341.23123 202.4
[M+Na-2H]- 303.19205 162.8
[M]+ 282.21683 157.6
[M]- 282.21793 157.6
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