CID 145915532

1812184-92-1

Structural Information

Molecular Formula
C19H36B2O6
SMILES
B1(OC(C(O1)(C)C)(C)C)C(B2OC(C(O2)(C)C)(C)C)CC(=O)OC(C)(C)C
InChI
InChI=1S/C19H36B2O6/c1-15(2,3)23-14(22)12-13(20-24-16(4,5)17(6,7)25-20)21-26-18(8,9)19(10,11)27-21/h13H,12H2,1-11H3
InChIKey
DYEDUZKPSWMEPZ-UHFFFAOYSA-N
Compound name
tert-butyl 3,3-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

382.2698 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.27708 174.7
[M+Na]+ 405.25902 180.8
[M+NH4]+ 400.30362 184.3
[M+K]+ 421.23296 177.6
[M-H]- 381.26252 178.7
[M+Na-2H]- 403.24447 179.3
[M]+ 382.26925 177.3
[M]- 382.27035 177.3
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.