CID 2761145

2-(5-piperidin-4-yl-1,2,4-oxadiazol-3-yl)pyrazine

Structural Information

Molecular Formula
C11H13N5O
SMILES
C1CNCCC1C2=NC(=NO2)C3=NC=CN=C3
InChI
InChI=1S/C11H13N5O/c1-3-12-4-2-8(1)11-15-10(16-17-11)9-7-13-5-6-14-9/h5-8,12H,1-4H2
InChIKey
KYFNBVXPLAKRKM-UHFFFAOYSA-N
Compound name
5-piperidin-4-yl-3-pyrazin-2-yl-1,2,4-oxadiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

231.11201 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.11929 152.0
[M+Na]+ 254.10123 158.7
[M-H]- 230.10473 153.7
[M+NH4]+ 249.14583 161.8
[M+K]+ 270.07517 155.0
[M+H-H2O]+ 214.10927 140.5
[M+HCOO]- 276.11021 166.0
[M+CH3COO]- 290.12586 161.7
[M+Na-2H]- 252.08668 156.8
[M]+ 231.11146 146.9
[M]- 231.11256 146.9
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