CID 15280

N-acetyl-n-propylacetamide

Structural Information

Molecular Formula
C7H13NO2
SMILES
CCCN(C(=O)C)C(=O)C
InChI
InChI=1S/C7H13NO2/c1-4-5-8(6(2)9)7(3)10/h4-5H2,1-3H3
InChIKey
VZJZGMRFZOEBAC-UHFFFAOYSA-N
Compound name
N-acetyl-N-propylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

143.09464 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.101916 131.1
[M+Na]+ 166.083858 137.6
[M-H]- 142.087364 133.0
[M+NH4]+ 161.128463 153.1
[M+K]+ 182.057798 139.1
[M+H-H2O]+ 126.091900 126.1
[M+HCOO]- 188.092841 155.1
[M+CH3COO]- 202.108491 181.0
[M+Na-2H]- 164.069306 134.7
[M]+ 143.09409142 133.3
[M]- 143.09518858 133.3
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

patents stripe