CID 90937

23474-42-2

Structural Information

Molecular Formula
C9H7Cl2NO2
SMILES
C1=CC=C(C(=C1)C2(C(O2)Cl)C(=O)N)Cl
InChI
InChI=1S/C9H7Cl2NO2/c10-6-4-2-1-3-5(6)9(8(12)13)7(11)14-9/h1-4,7H,(H2,12,13)
InChIKey
ZLEOLTREQNOWMM-UHFFFAOYSA-N
Compound name
3-chloro-2-(2-chlorophenyl)oxirane-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

230.98538 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.99266 143.6
[M+Na]+ 253.97460 158.8
[M+NH4]+ 249.01920 154.2
[M+K]+ 269.94854 152.3
[M-H]- 229.97810 154.8
[M+Na-2H]- 251.96005 154.4
[M]+ 230.98483 150.8
[M]- 230.98593 150.8
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

No patent data available for this compound.