CID 59643963

852204-67-2

Structural Information

Molecular Formula
C14H22BO5P
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)P(=O)(OC)OC
InChI
InChI=1S/C14H22BO5P/c1-13(2)14(3,4)20-15(19-13)11-7-9-12(10-8-11)21(16,17-5)18-6/h7-10H,1-6H3
InChIKey
CUAVYPNLRRVECY-UHFFFAOYSA-N
Compound name
2-(4-dimethoxyphosphorylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

63
Patents

312.1298 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.137076 166.6
[M+Na]+ 335.119018 175.2
[M-H]- 311.122524 174.1
[M+NH4]+ 330.163623 185.5
[M+K]+ 351.092958 177.1
[M+H-H2O]+ 295.127060 160.4
[M+HCOO]- 357.128001 191.6
[M+CH3COO]- 371.143651 204.9
[M+Na-2H]- 333.104466 170.9
[M]+ 312.12925142 174.4
[M]- 312.13034858 174.4
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

patents stripe