CID 3054961

71824-54-9

Structural Information

Molecular Formula
C13H18N2O
SMILES
CCCC(CC=C)(C1=CC=CC=N1)C(=O)N
InChI
InChI=1S/C13H18N2O/c1-3-8-13(9-4-2,12(14)16)11-7-5-6-10-15-11/h3,5-7,10H,1,4,8-9H2,2H3,(H2,14,16)
InChIKey
QCOCNTHCWCKXBU-UHFFFAOYSA-N
Compound name
2-propyl-2-pyridin-2-ylpent-4-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.1419 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.14918 152.4
[M+Na]+ 241.13112 162.7
[M+NH4]+ 236.17572 159.0
[M+K]+ 257.10506 156.9
[M-H]- 217.13462 153.0
[M+Na-2H]- 239.11657 157.8
[M]+ 218.14135 153.8
[M]- 218.14245 153.8
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.