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]+ 228.04221 145.8
[M+Na]+ 250.02415 153.8
[M-H]- 226.02765 149.7
[M+NH4]+ 245.06875 164.6
[M+K]+ 265.99809 150.9
[M+H-H2O]+ 210.03219 140.6
[M+HCOO]- 272.03313 165.8
[M+CH3COO]- 286.04878 188.9
[M+Na-2H]- 248.00960 150.2
[M]+ 227.03438 149.3
[M]- 227.03548 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.