CID 51676

2,5-diphenyl-1,3,5,2-dioxaphosphaborinane

Structural Information

Molecular Formula
C14H14BO2P
SMILES
B1(OCP(CO1)C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C14H14BO2P/c1-3-7-13(8-4-1)15-16-11-18(12-17-15)14-9-5-2-6-10-14/h1-10H,11-12H2
InChIKey
UAJYHLZAJDSTDC-UHFFFAOYSA-N
Compound name
2,5-diphenyl-1,3,5,2-dioxaphosphaborinane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.08246 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.08974 159.6
[M+Na]+ 279.07168 164.5
[M-H]- 255.07518 168.4
[M+NH4]+ 274.11628 173.4
[M+K]+ 295.04562 163.5
[M+H-H2O]+ 239.07972 148.7
[M+HCOO]- 301.08066 184.2
[M+CH3COO]- 315.09631 171.2
[M+Na-2H]- 277.05713 162.7
[M]+ 256.08191 157.2
[M]- 256.08301 157.2
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

No patent data available for this compound.