CID 237901

4-(chloromethyl)-2-(4-chlorophenyl)-1,3-dioxolane

Structural Information

Molecular Formula
C10H10Cl2O2
SMILES
C1C(OC(O1)C2=CC=C(C=C2)Cl)CCl
InChI
InChI=1S/C10H10Cl2O2/c11-5-9-6-13-10(14-9)7-1-3-8(12)4-2-7/h1-4,9-10H,5-6H2
InChIKey
PWUSSDSFKIJXBB-UHFFFAOYSA-N
Compound name
4-(chloromethyl)-2-(4-chlorophenyl)-1,3-dioxolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.00578 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.01306 148.7
[M+Na]+ 254.99500 157.9
[M-H]- 230.99850 155.7
[M+NH4]+ 250.03960 167.0
[M+K]+ 270.96894 155.0
[M+H-H2O]+ 215.00304 144.1
[M+HCOO]- 277.00398 160.8
[M+CH3COO]- 291.01963 161.9
[M+Na-2H]- 252.98045 153.0
[M]+ 232.00523 152.0
[M]- 232.00633 152.0
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.