CID 54592652

1-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-amine

Structural Information

Molecular Formula
C10H18N4O
SMILES
CCC1=NC(=NO1)CN2CCCC(C2)N
InChI
InChI=1S/C10H18N4O/c1-2-10-12-9(13-15-10)7-14-5-3-4-8(11)6-14/h8H,2-7,11H2,1H3
InChIKey
ZCDIOCPFJFEXGB-UHFFFAOYSA-N
Compound name
1-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.14806 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.15534 149.4
[M+Na]+ 233.13728 155.7
[M-H]- 209.14078 151.7
[M+NH4]+ 228.18188 164.0
[M+K]+ 249.11122 154.1
[M+H-H2O]+ 193.14532 140.2
[M+HCOO]- 255.14626 167.3
[M+CH3COO]- 269.16191 187.7
[M+Na-2H]- 231.12273 152.4
[M]+ 210.14751 146.2
[M]- 210.14861 146.2
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.