CID 2366967

N-(2-chloroacetyl)-2-methoxybenzamide

Structural Information

Molecular Formula
C10H10ClNO3
SMILES
COC1=CC=CC=C1C(=O)NC(=O)CCl
InChI
InChI=1S/C10H10ClNO3/c1-15-8-5-3-2-4-7(8)10(14)12-9(13)6-11/h2-5H,6H2,1H3,(H,12,13,14)
InChIKey
ICBGINVOKCHKSA-UHFFFAOYSA-N
Compound name
N-(2-chloroacetyl)-2-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.03493 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.042206 145.8
[M+Na]+ 250.024148 153.8
[M-H]- 226.027654 149.7
[M+NH4]+ 245.068753 164.6
[M+K]+ 265.998088 150.9
[M+H-H2O]+ 210.032190 140.6
[M+HCOO]- 272.033131 165.8
[M+CH3COO]- 286.048781 188.9
[M+Na-2H]- 248.009596 150.2
[M]+ 227.03438142 149.3
[M]- 227.03547858 149.3
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

No patent data available for this compound.