CID 24698982

1017048-74-6

Structural Information

Molecular Formula
C7H7N3OS
SMILES
CC1=C(SC=C1)C2=NN=C(O2)N
InChI
InChI=1S/C7H7N3OS/c1-4-2-3-12-5(4)6-9-10-7(8)11-6/h2-3H,1H3,(H2,8,10)
InChIKey
KIMICPXEHOKXNU-UHFFFAOYSA-N
Compound name
5-(3-methylthiophen-2-yl)-1,3,4-oxadiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

181.03099 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.03827 134.8
[M+Na]+ 204.02021 147.1
[M+NH4]+ 199.06481 143.3
[M+K]+ 219.99415 143.8
[M-H]- 180.02371 139.0
[M+Na-2H]- 202.00566 141.2
[M]+ 181.03044 138.1
[M]- 181.03154 138.1
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.