CID 3069223

Brn 5682325

Structural Information

Molecular Formula
C28H24O10Te
SMILES
COC1=CC=C(C=C1)[Te](C2=CC=C(C=C2)OC)(OC(=O)C3=C(C=C(C=C3)O)O)OC(=O)C4=C(C=C(C=C4)O)O
InChI
InChI=1S/C28H24O10Te/c1-35-19-5-9-21(10-6-19)39(22-11-7-20(36-2)8-12-22,37-27(33)23-13-3-17(29)15-25(23)31)38-28(34)24-14-4-18(30)16-26(24)32/h3-16,29-32H,1-2H3
InChIKey
FXOFXPJCTXMFQL-UHFFFAOYSA-N
Compound name
[(2,4-dihydroxybenzoyl)oxy-bis(4-methoxyphenyl)-lambda4-tellanyl] 2,4-dihydroxybenzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

650.04315 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 651.05043 242.2
[M+Na]+ 673.03237 244.4
[M-H]- 649.03587 249.0
[M+NH4]+ 668.07697 241.9
[M+K]+ 689.00631 243.2
[M+H-H2O]+ 633.04041 229.5
[M+HCOO]- 695.04135 254.3
[M+CH3COO]- 709.05700 243.4
[M+Na-2H]- 671.01782 239.4
[M]+ 650.04260 246.3
[M]- 650.04370 246.3
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.