CID 203120

13941-03-2

Structural Information

Molecular Formula
C7H15NO
SMILES
CCCC(CC)C(=O)N
InChI
InChI=1S/C7H15NO/c1-3-5-6(4-2)7(8)9/h6H,3-5H2,1-2H3,(H2,8,9)
InChIKey
ZRFXAOXSSXSMRI-UHFFFAOYSA-N
Compound name
2-ethylpentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

504
Patents

129.11537 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.12265 129.7
[M+Na]+ 152.10459 138.4
[M+NH4]+ 147.14919 137.2
[M+K]+ 168.07853 133.9
[M-H]- 128.10809 129.2
[M+Na-2H]- 150.09004 132.5
[M]+ 129.11482 130.5
[M]- 129.11592 130.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe