CID 121237740

1260032-45-8

Structural Information

Molecular Formula
C31H29BO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC=C2)C3(C4=CC=CC=C4C5=CC=CC=C53)C6=CC=CC=C6
InChI
InChI=1S/C31H29BO2/c1-29(2)30(3,4)34-32(33-29)24-16-12-15-23(21-24)31(22-13-6-5-7-14-22)27-19-10-8-17-25(27)26-18-9-11-20-28(26)31/h5-21H,1-4H3
InChIKey
DFOHBZPAVOZPOY-UHFFFAOYSA-N
Compound name
4,4,5,5-tetramethyl-2-[3-(9-phenylfluoren-9-yl)phenyl]-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

44
Patents

444.22607 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 445.23335 209.7
[M+Na]+ 467.21529 220.0
[M-H]- 443.21879 226.2
[M+NH4]+ 462.25989 227.2
[M+K]+ 483.18923 214.7
[M+H-H2O]+ 427.22333 199.4
[M+HCOO]- 489.22427 227.1
[M+CH3COO]- 503.23992 220.4
[M+Na-2H]- 465.20074 209.9
[M]+ 444.22552 212.5
[M]- 444.22662 212.5
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