CID 11159822

N-(3-acetylphenyl)-n-methylacetamide

Structural Information

Molecular Formula
C11H13NO2
SMILES
CC(=O)C1=CC(=CC=C1)N(C)C(=O)C
InChI
InChI=1S/C11H13NO2/c1-8(13)10-5-4-6-11(7-10)12(3)9(2)14/h4-7H,1-3H3
InChIKey
FTTSEBPNAOFITJ-UHFFFAOYSA-N
Compound name
N-(3-acetylphenyl)-N-methylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

191.09464 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.101916 140.6
[M+Na]+ 214.083858 147.6
[M-H]- 190.087364 146.0
[M+NH4]+ 209.128463 160.6
[M+K]+ 230.057798 147.4
[M+H-H2O]+ 174.091900 134.4
[M+HCOO]- 236.092841 165.0
[M+CH3COO]- 250.108491 190.2
[M+Na-2H]- 212.069306 144.3
[M]+ 191.09409142 142.4
[M]- 191.09518858 142.4
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

patents stripe