CID 184314

104500-00-7

Structural Information

Molecular Formula
C14H10S2
SMILES
C1=CC(=CC(=C1)C2=CC=CS2)C3=CC=CS3
InChI
InChI=1S/C14H10S2/c1-4-11(13-6-2-8-15-13)10-12(5-1)14-7-3-9-16-14/h1-10H
InChIKey
RLAVULCSJXKELC-UHFFFAOYSA-N
Compound name
2-(3-thiophen-2-ylphenyl)thiophene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

27
Patents

242.0224 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.02968 152.2
[M+Na]+ 265.01162 164.6
[M-H]- 241.01512 163.8
[M+NH4]+ 260.05622 174.8
[M+K]+ 280.98556 158.9
[M+H-H2O]+ 225.01966 147.2
[M+HCOO]- 287.02060 171.2
[M+CH3COO]- 301.03625 167.0
[M+Na-2H]- 262.99707 152.2
[M]+ 242.02185 156.4
[M]- 242.02295 156.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe