CID 10559014

5-(5-methyl-1,3,4-oxadiazol-2-yl)pyrrolidin-2-one

Structural Information

Molecular Formula
C7H9N3O2
SMILES
CC1=NN=C(O1)C2CCC(=O)N2
InChI
InChI=1S/C7H9N3O2/c1-4-9-10-7(12-4)5-2-3-6(11)8-5/h5H,2-3H2,1H3,(H,8,11)
InChIKey
XQNLVWIKYFLXAD-UHFFFAOYSA-N
Compound name
5-(5-methyl-1,3,4-oxadiazol-2-yl)pyrrolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.06947 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.07675 133.3
[M+Na]+ 190.05869 142.3
[M-H]- 166.06219 135.8
[M+NH4]+ 185.10329 151.2
[M+K]+ 206.03263 141.4
[M+H-H2O]+ 150.06673 125.9
[M+HCOO]- 212.06767 152.8
[M+CH3COO]- 226.08332 173.2
[M+Na-2H]- 188.04414 136.3
[M]+ 167.06892 131.8
[M]- 167.07002 131.8
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.