CID 33679829

1170460-87-3

Structural Information

Molecular Formula
C7H9N5O
SMILES
CC1=CC(=NN1C)C2=NN=C(O2)N
InChI
InChI=1S/C7H9N5O/c1-4-3-5(11-12(4)2)6-9-10-7(8)13-6/h3H,1-2H3,(H2,8,10)
InChIKey
IJJYBMUCTIEDNE-UHFFFAOYSA-N
Compound name
5-(1,5-dimethylpyrazol-3-yl)-1,3,4-oxadiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

179.0807 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.087976 135.0
[M+Na]+ 202.069918 147.4
[M-H]- 178.073424 138.6
[M+NH4]+ 197.114523 152.0
[M+K]+ 218.043858 145.9
[M+H-H2O]+ 162.077960 126.6
[M+HCOO]- 224.078901 159.0
[M+CH3COO]- 238.094551 149.4
[M+Na-2H]- 200.055366 139.9
[M]+ 179.08015142 138.2
[M]- 179.08124858 138.2
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.