CID 3049024

Tellurium, bis(p-methoxyphenyl)bis(thiocyanato)-

Structural Information

Molecular Formula
C16H14N2O2S2Te
SMILES
COC1=CC=C(C=C1)[Te](C2=CC=C(C=C2)OC)(N=C=S)N=C=S
InChI
InChI=1S/C16H14N2O2S2Te/c1-19-13-3-7-15(8-4-13)23(17-11-21,18-12-22)16-9-5-14(20-2)6-10-16/h3-10H,1-2H3
InChIKey
UOHZPUPVXXIJAP-UHFFFAOYSA-N
Compound name
1-[diisothiocyanato-(4-methoxyphenyl)-lambda4-tellanyl]-4-methoxybenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

459.9559 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 460.963176 201.0
[M+Na]+ 482.945118 207.8
[M-H]- 458.948624 208.7
[M+NH4]+ 477.989723 214.4
[M+K]+ 498.919058 200.5
[M+H-H2O]+ 442.953160 191.0
[M+HCOO]- 504.954101 216.6
[M+CH3COO]- 518.969751 220.2
[M+Na-2H]- 480.930566 201.9
[M]+ 459.95535142 205.9
[M]- 459.95644858 205.9
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.