CID 43810597

2-{[bis(4-chlorophenyl)methoxy]methyl}oxirane

Structural Information

Molecular Formula
C16H14Cl2O2
SMILES
C1C(O1)COC(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C16H14Cl2O2/c17-13-5-1-11(2-6-13)16(20-10-15-9-19-15)12-3-7-14(18)8-4-12/h1-8,15-16H,9-10H2
InChIKey
GKWPFUSVMXXVND-UHFFFAOYSA-N
Compound name
2-[bis(4-chlorophenyl)methoxymethyl]oxirane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

308.03708 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.04436 166.3
[M+Na]+ 331.02630 184.3
[M+NH4]+ 326.07090 176.5
[M+K]+ 347.00024 176.6
[M-H]- 307.02980 180.0
[M+Na-2H]- 329.01175 178.4
[M]+ 308.03653 174.7
[M]- 308.03763 174.7
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.