CID 31936

2-(2,4-dichlorophenyl)oxirane-2-carboxamide

Structural Information

Molecular Formula
C9H7Cl2NO2
SMILES
C1C(O1)(C2=C(C=C(C=C2)Cl)Cl)C(=O)N
InChI
InChI=1S/C9H7Cl2NO2/c10-5-1-2-6(7(11)3-5)9(4-14-9)8(12)13/h1-3H,4H2,(H2,12,13)
InChIKey
BSUVNHZVLSEXMX-UHFFFAOYSA-N
Compound name
2-(2,4-dichlorophenyl)oxirane-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

230.98538 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.99266 139.0
[M+Na]+ 253.97460 150.4
[M-H]- 229.97810 146.6
[M+NH4]+ 249.01920 153.7
[M+K]+ 269.94854 147.0
[M+H-H2O]+ 213.98264 135.2
[M+HCOO]- 275.98358 153.3
[M+CH3COO]- 289.99923 191.3
[M+Na-2H]- 251.96005 145.3
[M]+ 230.98483 144.6
[M]- 230.98593 144.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe