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]+ 227.21179 160.6
[M+Na]+ 249.19373 162.7
[M-H]- 225.19723 161.3
[M+NH4]+ 244.23833 178.4
[M+K]+ 265.16767 161.8
[M+H-H2O]+ 209.20177 153.1
[M+HCOO]- 271.20271 178.7
[M+CH3COO]- 285.21836 194.7
[M+Na-2H]- 247.17918 158.8
[M]+ 226.20396 158.2
[M]- 226.20506 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.