CID 43556121

3-(thiophen-3-yl)-1,2,4-thiadiazol-5-amine

Structural Information

Molecular Formula
C6H5N3S2
SMILES
C1=CSC=C1C2=NSC(=N2)N
InChI
InChI=1S/C6H5N3S2/c7-6-8-5(9-11-6)4-1-2-10-3-4/h1-3H,(H2,7,8,9)
InChIKey
QFXHCHSYJLLXCM-UHFFFAOYSA-N
Compound name
3-thiophen-3-yl-1,2,4-thiadiazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.9925 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.99978 132.8
[M+Na]+ 205.98172 144.4
[M+NH4]+ 201.02632 142.3
[M+K]+ 221.95566 138.2
[M-H]- 181.98522 136.4
[M+Na-2H]- 203.96717 139.5
[M]+ 182.99195 136.3
[M]- 182.99305 136.3
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

No patent data available for this compound.