CID 344971

2-chloro-2-phenylacetamide

Structural Information

Molecular Formula
C8H8ClNO
SMILES
C1=CC=C(C=C1)C(C(=O)N)Cl
InChI
InChI=1S/C8H8ClNO/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5,7H,(H2,10,11)
InChIKey
FJEOFVLOXGUWBH-UHFFFAOYSA-N
Compound name
2-chloro-2-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

302
Patents

169.02943 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.03671 132.8
[M+Na]+ 192.01865 140.4
[M-H]- 168.02215 135.9
[M+NH4]+ 187.06325 153.3
[M+K]+ 207.99259 137.0
[M+H-H2O]+ 152.02669 128.1
[M+HCOO]- 214.02763 152.0
[M+CH3COO]- 228.04328 179.1
[M+Na-2H]- 190.00410 137.8
[M]+ 169.02888 132.1
[M]- 169.02998 132.1
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