CID 342731

N-(2-acetamido-4,5-dimethylphenyl)acetamide

Structural Information

Molecular Formula
C12H16N2O2
SMILES
CC1=CC(=C(C=C1C)NC(=O)C)NC(=O)C
InChI
InChI=1S/C12H16N2O2/c1-7-5-11(13-9(3)15)12(6-8(7)2)14-10(4)16/h5-6H,1-4H3,(H,13,15)(H,14,16)
InChIKey
VMOQGOAWGLCADB-UHFFFAOYSA-N
Compound name
N-(2-acetamido-4,5-dimethylphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

220.12119 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.12847 151.1
[M+Na]+ 243.11041 161.5
[M+NH4]+ 238.15501 157.8
[M+K]+ 259.08435 156.5
[M-H]- 219.11391 153.0
[M+Na-2H]- 241.09586 155.8
[M]+ 220.12064 152.8
[M]- 220.12174 152.8
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