CID 670477

2-chloro-n-(2-ethyl-6-methylphenyl)acetamide

Structural Information

Molecular Formula
C11H14ClNO
SMILES
CCC1=CC=CC(=C1NC(=O)CCl)C
InChI
InChI=1S/C11H14ClNO/c1-3-9-6-4-5-8(2)11(9)13-10(14)7-12/h4-6H,3,7H2,1-2H3,(H,13,14)
InChIKey
SMINYPCTNJDYGK-UHFFFAOYSA-N
Compound name
2-chloro-N-(2-ethyl-6-methylphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

73
Patents

211.07639 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.08367 145.3
[M+Na]+ 234.06561 158.4
[M+NH4]+ 229.11021 154.0
[M+K]+ 250.03955 151.0
[M-H]- 210.06911 148.0
[M+Na-2H]- 232.05106 152.0
[M]+ 211.07584 148.2
[M]- 211.07694 148.2
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

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