CID 3075963

Diphenylsilylene 2,4-dibromobenzoate

Structural Information

Molecular Formula
C26H16Br4O4Si
SMILES
C1=CC=C(C=C1)[Si](C2=CC=CC=C2)(C3=C(C=CC(=C3Br)C(=O)O)Br)C4=C(C=CC(=C4Br)C(=O)O)Br
InChI
InChI=1S/C26H16Br4O4Si/c27-19-13-11-17(25(31)32)21(29)23(19)35(15-7-3-1-4-8-15,16-9-5-2-6-10-16)24-20(28)14-12-18(22(24)30)26(33)34/h1-14H,(H,31,32)(H,33,34)
InChIKey
GRYPNIZHNQLTBW-UHFFFAOYSA-N
Compound name
2,4-dibromo-3-[(2,6-dibromo-3-carboxyphenyl)-diphenylsilyl]benzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

735.7551 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 736.76238 178.9
[M+Na]+ 758.74432 174.0
[M+NH4]+ 753.78892 179.5
[M+K]+ 774.71826 179.5
[M-H]- 734.74782 181.1
[M+Na-2H]- 756.72977 179.6
[M]+ 735.75455 179.3
[M]- 735.75565 179.3
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.