CID 3054957

Alpha,alpha-dipropyl-2-pyridineacetamide

Structural Information

Molecular Formula
C13H20N2O
SMILES
CCCC(CCC)(C1=CC=CC=N1)C(=O)N
InChI
InChI=1S/C13H20N2O/c1-3-8-13(9-4-2,12(14)16)11-7-5-6-10-15-11/h5-7,10H,3-4,8-9H2,1-2H3,(H2,14,16)
InChIKey
CGOGGAQCPPPQJZ-UHFFFAOYSA-N
Compound name
2-propyl-2-pyridin-2-ylpentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

220.15756 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.16484 153.8
[M+Na]+ 243.14678 159.1
[M-H]- 219.15028 155.0
[M+NH4]+ 238.19138 170.2
[M+K]+ 259.12072 156.5
[M+H-H2O]+ 203.15482 146.7
[M+HCOO]- 265.15576 174.0
[M+CH3COO]- 279.17141 192.5
[M+Na-2H]- 241.13223 158.6
[M]+ 220.15701 153.5
[M]- 220.15811 153.5
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.