CID 16450167

5-cyclobutyl-1,3,4-thiadiazol-2-amine

Structural Information

Molecular Formula
C6H9N3S
SMILES
C1CC(C1)C2=NN=C(S2)N
InChI
InChI=1S/C6H9N3S/c7-6-9-8-5(10-6)4-2-1-3-4/h4H,1-3H2,(H2,7,9)
InChIKey
ROBHTWLKDVLHNY-UHFFFAOYSA-N
Compound name
5-cyclobutyl-1,3,4-thiadiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

155.05171 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.05899 124.7
[M+Na]+ 178.04093 130.6
[M+NH4]+ 173.08553 129.7
[M+K]+ 194.01487 127.5
[M-H]- 154.04443 124.6
[M+Na-2H]- 176.02638 128.4
[M]+ 155.05116 124.6
[M]- 155.05226 124.6
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