CID 48371

Ethylphenacetin

Structural Information

Molecular Formula
C12H17NO2
SMILES
CCN(C1=CC=C(C=C1)OCC)C(=O)C
InChI
InChI=1S/C12H17NO2/c1-4-13(10(3)14)11-6-8-12(9-7-11)15-5-2/h6-9H,4-5H2,1-3H3
InChIKey
IWXURAOZPFLNQM-UHFFFAOYSA-N
Compound name
N-(4-ethoxyphenyl)-N-ethylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

207.12593 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.13321 147.0
[M+Na]+ 230.11515 153.5
[M-H]- 206.11865 152.0
[M+NH4]+ 225.15975 166.5
[M+K]+ 246.08909 153.1
[M+H-H2O]+ 190.12319 140.4
[M+HCOO]- 252.12413 171.9
[M+CH3COO]- 266.13978 193.2
[M+Na-2H]- 228.10060 151.2
[M]+ 207.12538 150.4
[M]- 207.12648 150.4
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.