CID 207732

Propane, 1,1-bis(p-chlorophenyl)-2,2-dimethyl-1,3-epoxy-

Structural Information

Molecular Formula
C17H16Cl2O
SMILES
CC1(COC1(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C
InChI
InChI=1S/C17H16Cl2O/c1-16(2)11-20-17(16,12-3-7-14(18)8-4-12)13-5-9-15(19)10-6-13/h3-10H,11H2,1-2H3
InChIKey
HNYZIACDFSRNTN-UHFFFAOYSA-N
Compound name
2,2-bis(4-chlorophenyl)-3,3-dimethyloxetane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.05783 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.06511 156.4
[M+Na]+ 329.04705 170.2
[M+NH4]+ 324.09165 165.8
[M+K]+ 345.02099 159.4
[M-H]- 305.05055 162.0
[M+Na-2H]- 327.03250 167.7
[M]+ 306.05728 160.2
[M]- 306.05838 160.2
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.