CID 3071447

2-ethyl-3-methyl-n-(1-pyrrolidinylmethyl)pentanamide hydrochloride

Structural Information

Molecular Formula
C13H26N2O
SMILES
CCC(C)C(CC)C(=O)NCN1CCCC1
InChI
InChI=1S/C13H26N2O/c1-4-11(3)12(5-2)13(16)14-10-15-8-6-7-9-15/h11-12H,4-10H2,1-3H3,(H,14,16)
InChIKey
UEZCZBZNJGFRFW-UHFFFAOYSA-N
Compound name
2-ethyl-3-methyl-N-(pyrrolidin-1-ylmethyl)pentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.20451 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.211786 160.6
[M+Na]+ 249.193728 162.7
[M-H]- 225.197234 161.3
[M+NH4]+ 244.238333 178.4
[M+K]+ 265.167668 161.8
[M+H-H2O]+ 209.201770 153.1
[M+HCOO]- 271.202711 178.7
[M+CH3COO]- 285.218361 194.7
[M+Na-2H]- 247.179176 158.8
[M]+ 226.20396142 158.2
[M]- 226.20505858 158.2
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.