CID 64545484

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

Structural Information

Molecular Formula
C7H11N3OS
SMILES
C1COCCC1C2=NC(=NS2)N
InChI
InChI=1S/C7H11N3OS/c8-7-9-6(12-10-7)5-1-3-11-4-2-5/h5H,1-4H2,(H2,8,10)
InChIKey
WDHZFAPKPRYUSC-UHFFFAOYSA-N
Compound name
5-(oxan-4-yl)-1,2,4-thiadiazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.06229 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.06957 137.2
[M+Na]+ 208.05151 147.5
[M+NH4]+ 203.09611 145.8
[M+K]+ 224.02545 142.4
[M-H]- 184.05501 141.4
[M+Na-2H]- 206.03696 142.4
[M]+ 185.06174 140.1
[M]- 185.06284 140.1
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.