CID 21170

N-(2,4,6-trimethylphenyl)acetamide

Structural Information

Molecular Formula
C11H15NO
SMILES
CC1=CC(=C(C(=C1)C)NC(=O)C)C
InChI
InChI=1S/C11H15NO/c1-7-5-8(2)11(9(3)6-7)12-10(4)13/h5-6H,1-4H3,(H,12,13)
InChIKey
LQWWZVZGPVVZOB-UHFFFAOYSA-N
Compound name
N-(2,4,6-trimethylphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

104
Patents

177.11537 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.12265 139.4
[M+Na]+ 200.10459 152.2
[M+NH4]+ 195.14919 147.9
[M+K]+ 216.07853 145.8
[M-H]- 176.10809 142.3
[M+Na-2H]- 198.09004 145.8
[M]+ 177.11482 142.0
[M]- 177.11592 142.0
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