CID 205828

2-cyano-2-ethylpentanamide

Structural Information

Molecular Formula
C8H14N2O
SMILES
CCCC(CC)(C#N)C(=O)N
InChI
InChI=1S/C8H14N2O/c1-3-5-8(4-2,6-9)7(10)11/h3-5H2,1-2H3,(H2,10,11)
InChIKey
GQEAGAYBSSTQEJ-UHFFFAOYSA-N
Compound name
2-cyano-2-ethylpentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

154.11061 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.117886 137.5
[M+Na]+ 177.099828 145.2
[M-H]- 153.103334 137.8
[M+NH4]+ 172.144433 156.1
[M+K]+ 193.073768 144.8
[M+H-H2O]+ 137.107870 126.4
[M+HCOO]- 199.108811 155.6
[M+CH3COO]- 213.124461 193.1
[M+Na-2H]- 175.085276 141.7
[M]+ 154.11006142 132.3
[M]- 154.11115858 132.3
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.