CID 73808

N-acetyl-n-ethylacetamide

Structural Information

Molecular Formula
C6H11NO2
SMILES
CCN(C(=O)C)C(=O)C
InChI
InChI=1S/C6H11NO2/c1-4-7(5(2)8)6(3)9/h4H2,1-3H3
InChIKey
OUUWATVJTLBCFV-UHFFFAOYSA-N
Compound name
N-acetyl-N-ethylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

80
Patents

129.07898 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.086256 126.4
[M+Na]+ 152.068198 133.2
[M-H]- 128.071704 128.5
[M+NH4]+ 147.112803 148.9
[M+K]+ 168.042138 135.1
[M+H-H2O]+ 112.076240 121.5
[M+HCOO]- 174.077181 150.7
[M+CH3COO]- 188.092831 178.0
[M+Na-2H]- 150.053646 130.5
[M]+ 129.07843142 128.2
[M]- 129.07952858 128.2
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