CID 11206265

2-(2,6-dichlorophenyl)oxirane

Structural Information

Molecular Formula
C8H6Cl2O
SMILES
C1C(O1)C2=C(C=CC=C2Cl)Cl
InChI
InChI=1S/C8H6Cl2O/c9-5-2-1-3-6(10)8(5)7-4-11-7/h1-3,7H,4H2
InChIKey
OABUMCRYAMBARC-UHFFFAOYSA-N
Compound name
2-(2,6-dichlorophenyl)oxirane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

187.97957 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.986846 129.2
[M+Na]+ 210.968788 141.1
[M-H]- 186.972294 136.8
[M+NH4]+ 206.013393 144.4
[M+K]+ 226.942728 137.6
[M+H-H2O]+ 170.976830 124.2
[M+HCOO]- 232.977771 144.1
[M+CH3COO]- 246.993421 143.5
[M+Na-2H]- 208.954236 136.7
[M]+ 187.97902142 135.1
[M]- 187.98011858 135.1
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