CID 13141433

Benzene, 2,4-dichloro-1-(ethenyloxy)-

Structural Information

Molecular Formula
C8H6Cl2O
SMILES
C=COC1=C(C=C(C=C1)Cl)Cl
InChI
InChI=1S/C8H6Cl2O/c1-2-11-8-4-3-6(9)5-7(8)10/h2-5H,1H2
InChIKey
WZYSGPKKNXSNMG-UHFFFAOYSA-N
Compound name
2,4-dichloro-1-ethenoxybenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

229
Patents

187.97957 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.98685 132.0
[M+Na]+ 210.96879 143.1
[M-H]- 186.97229 135.5
[M+NH4]+ 206.01339 153.4
[M+K]+ 226.94273 137.9
[M+H-H2O]+ 170.97683 128.6
[M+HCOO]- 232.97777 147.6
[M+CH3COO]- 246.99342 180.4
[M+Na-2H]- 208.95424 138.2
[M]+ 187.97902 135.9
[M]- 187.98012 135.9
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