CID 45822598

{1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl}methanol

Structural Information

Molecular Formula
C10H17N3O2
SMILES
CC1=NOC(=N1)CN2CCC(CC2)CO
InChI
InChI=1S/C10H17N3O2/c1-8-11-10(15-12-8)6-13-4-2-9(7-14)3-5-13/h9,14H,2-7H2,1H3
InChIKey
PNQZHWFCGULKMU-UHFFFAOYSA-N
Compound name
[1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.13208 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.139356 148.6
[M+Na]+ 234.121298 155.2
[M-H]- 210.124804 150.0
[M+NH4]+ 229.165903 162.9
[M+K]+ 250.095238 153.7
[M+H-H2O]+ 194.129340 139.9
[M+HCOO]- 256.130281 164.7
[M+CH3COO]- 270.145931 183.0
[M+Na-2H]- 232.106746 151.6
[M]+ 211.13153142 146.6
[M]- 211.13262858 146.6
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.