CID 226226

1,1,3,3-tetra(2-thienyl)diarsoxane

Structural Information

Molecular Formula
C16H12As2OS4
SMILES
C1=CSC(=C1)[As](C2=CC=CS2)O[As](C3=CC=CS3)C4=CC=CS4
InChI
InChI=1S/C16H12As2OS4/c1-5-13(20-9-1)17(14-6-2-10-21-14)19-18(15-7-3-11-22-15)16-8-4-12-23-16/h1-12H
InChIKey
ZWFODMWMPCNSSM-UHFFFAOYSA-N
Compound name
dithiophen-2-ylarsanyloxy(dithiophen-2-yl)arsane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

497.82028 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 498.82756 212.4
[M+Na]+ 520.80950 225.4
[M-H]- 496.81300 225.8
[M+NH4]+ 515.85410 231.7
[M+K]+ 536.78344 219.5
[M+H-H2O]+ 480.81754 209.8
[M+HCOO]- 542.81848 221.4
[M+CH3COO]- 556.83413 223.0
[M+Na-2H]- 518.79495 205.6
[M]+ 497.81973 218.2
[M]- 497.82083 218.2
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.