CID 53720219

N-(ethoxymethyl)-n-(2-ethyl-6-methylphenyl)acetamide

Structural Information

Molecular Formula
C14H21NO2
SMILES
CCC1=CC=CC(=C1N(COCC)C(=O)C)C
InChI
InChI=1S/C14H21NO2/c1-5-13-9-7-8-11(3)14(13)15(12(4)16)10-17-6-2/h7-9H,5-6,10H2,1-4H3
InChIKey
CGTPWDSKALFRMS-UHFFFAOYSA-N
Compound name
N-(ethoxymethyl)-N-(2-ethyl-6-methylphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

235.15723 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.164506 155.7
[M+Na]+ 258.146448 162.2
[M-H]- 234.149954 160.7
[M+NH4]+ 253.191053 174.3
[M+K]+ 274.120388 161.4
[M+H-H2O]+ 218.154490 148.9
[M+HCOO]- 280.155431 179.8
[M+CH3COO]- 294.171081 200.4
[M+Na-2H]- 256.131896 158.1
[M]+ 235.15668142 160.2
[M]- 235.15777858 160.2
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