CID 1822717

Pentanamide, n-(1-(ethylsulfonyl)-4-piperidinyl)-2-propyl-

Structural Information

Molecular Formula
C15H30N2O3S
SMILES
CCCC(CCC)C(=O)NC1CCN(CC1)S(=O)(=O)CC
InChI
InChI=1S/C15H30N2O3S/c1-4-7-13(8-5-2)15(18)16-14-9-11-17(12-10-14)21(19,20)6-3/h13-14H,4-12H2,1-3H3,(H,16,18)
InChIKey
JWRIGMBBZXZABT-UHFFFAOYSA-N
Compound name
N-(1-ethylsulfonylpiperidin-4-yl)-2-propylpentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.19772 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.20500 176.8
[M+Na]+ 341.18694 178.9
[M-H]- 317.19044 177.1
[M+NH4]+ 336.23154 189.7
[M+K]+ 357.16088 176.2
[M+H-H2O]+ 301.19498 169.5
[M+HCOO]- 363.19592 187.0
[M+CH3COO]- 377.21157 207.9
[M+Na-2H]- 339.17239 174.7
[M]+ 318.19717 177.3
[M]- 318.19827 177.3
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.