CID 200810

Brn 2444645

Structural Information

Molecular Formula
C15H32N2O
SMILES
CCCC(CCC)C(=O)NCCCN(CC)CC
InChI
InChI=1S/C15H32N2O/c1-5-10-14(11-6-2)15(18)16-12-9-13-17(7-3)8-4/h14H,5-13H2,1-4H3,(H,16,18)
InChIKey
GLFPEPMDVXCKFF-UHFFFAOYSA-N
Compound name
N-[3-(diethylamino)propyl]-2-propylpentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.25146 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.25874 171.7
[M+Na]+ 279.24068 173.5
[M-H]- 255.24418 171.8
[M+NH4]+ 274.28528 188.7
[M+K]+ 295.21462 173.0
[M+H-H2O]+ 239.24872 164.5
[M+HCOO]- 301.24966 193.4
[M+CH3COO]- 315.26531 209.6
[M+Na-2H]- 277.22613 170.9
[M]+ 256.25091 175.3
[M]- 256.25201 175.3
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.