CID 420331

Bromo-(4-bromo-1,2,3,4-tetraphenylbuta-1,3-dienyl)-dimethylstannane

Structural Information

Molecular Formula
C30H26Br2Sn
SMILES
C[Sn](C)(C(=C(C1=CC=CC=C1)C(=C(C2=CC=CC=C2)Br)C3=CC=CC=C3)C4=CC=CC=C4)Br
InChI
InChI=1S/C28H20Br.2CH3.BrH.Sn/c29-28(25-19-11-4-12-20-25)27(24-17-9-3-10-18-24)26(23-15-7-2-8-16-23)21-22-13-5-1-6-14-22;;;;/h1-20H;2*1H3;1H;/q;;;;+1/p-1
InChIKey
SFLFCGFZSKZPPI-UHFFFAOYSA-M
Compound name
bromo-(4-bromo-1,2,3,4-tetraphenylbuta-1,3-dienyl)-dimethylstannane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

663.9423 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 664.94958 233.7
[M+Na]+ 686.93152 235.9
[M-H]- 662.93502 243.9
[M+NH4]+ 681.97612 241.4
[M+K]+ 702.90546 220.1
[M+H-H2O]+ 646.93956 238.8
[M+HCOO]- 708.94050 241.7
[M+CH3COO]- 722.95615 239.5
[M+Na-2H]- 684.91697 231.4
[M]+ 663.94175 262.6
[M]- 663.94285 262.6
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.