CID 2450175

2-chloro-n-methyl-n-(2-methylbenzyl)acetamide

Structural Information

Molecular Formula
C11H14ClNO
SMILES
CC1=CC=CC=C1CN(C)C(=O)CCl
InChI
InChI=1S/C11H14ClNO/c1-9-5-3-4-6-10(9)8-13(2)11(14)7-12/h3-6H,7-8H2,1-2H3
InChIKey
OPKQDGDFVIAJGX-UHFFFAOYSA-N
Compound name
2-chloro-N-methyl-N-[(2-methylphenyl)methyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.07639 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.08367 145.2
[M+Na]+ 234.06561 158.2
[M+NH4]+ 229.11021 154.2
[M+K]+ 250.03955 151.1
[M-H]- 210.06911 148.3
[M+Na-2H]- 232.05106 152.4
[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.

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No literature data available for this compound.

Patent stripe

No patent data available for this compound.