CID 15956039

2-(2-furyl)-6-phenyl-imidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile

Structural Information

Molecular Formula
C15H8N4OS
SMILES
C1=CC=C(C=C1)C2=C(N3C(=N2)SC(=N3)C4=CC=CO4)C#N
InChI
InChI=1S/C15H8N4OS/c16-9-11-13(10-5-2-1-3-6-10)17-15-19(11)18-14(21-15)12-7-4-8-20-12/h1-8H
InChIKey
GBLLDHOJAHFTFM-UHFFFAOYSA-N
Compound name
2-(furan-2-yl)-6-phenylimidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

292.04187 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.04915 168.7
[M+Na]+ 315.03109 185.2
[M-H]- 291.03459 176.2
[M+NH4]+ 310.07569 184.2
[M+K]+ 331.00503 179.0
[M+H-H2O]+ 275.03913 154.5
[M+HCOO]- 337.04007 185.8
[M+CH3COO]- 351.05572 180.8
[M+Na-2H]- 313.01654 168.6
[M]+ 292.04132 170.9
[M]- 292.04242 170.9
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

No patent data available for this compound.