CID 99353

Bis(p-phenoxyphenyl)diphenyltin

Structural Information

Molecular Formula
C36H28O2Sn
SMILES
C1=CC=C(C=C1)OC2=CC=C(C=C2)[Sn](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=C(C=C5)OC6=CC=CC=C6
InChI
InChI=1S/2C12H9O.2C6H5.Sn/c2*1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;2*1-2-4-6-5-3-1;/h2*1,3-10H;2*1-5H;
InChIKey
WLCKHJKBWHUTKD-UHFFFAOYSA-N
Compound name
bis(4-phenoxyphenyl)-diphenylstannane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

612.11115 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 613.11843 247.5
[M+Na]+ 635.10037 249.1
[M-H]- 611.10387 261.8
[M+NH4]+ 630.14497 249.3
[M+K]+ 651.07431 240.3
[M+H-H2O]+ 595.10841 230.9
[M+HCOO]- 657.10935 264.2
[M+CH3COO]- 671.12500 251.6
[M+Na-2H]- 633.08582 248.5
[M]+ 612.11060 244.0
[M]- 612.11170 244.0
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