CID 180764

Furan, 2-(2,2'-bithiophen)-5-yl-

Structural Information

Molecular Formula
C12H8OS2
SMILES
C1=COC(=C1)C2=CC=C(S2)C3=CC=CS3
InChI
InChI=1S/C12H8OS2/c1-3-9(13-7-1)10-5-6-12(15-10)11-4-2-8-14-11/h1-8H
InChIKey
SOUVBXUKDYVFHW-UHFFFAOYSA-N
Compound name
2-(5-thiophen-2-ylthiophen-2-yl)furan
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

232.00166 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.00894 149.6
[M+Na]+ 254.99088 163.1
[M-H]- 230.99438 162.8
[M+NH4]+ 250.03548 173.3
[M+K]+ 270.96482 160.6
[M+H-H2O]+ 214.99892 146.6
[M+HCOO]- 276.99986 169.9
[M+CH3COO]- 291.01551 165.6
[M+Na-2H]- 252.97633 148.9
[M]+ 232.00111 156.3
[M]- 232.00221 156.3
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

patents stripe