CID 417357

30668-06-5

Structural Information

Molecular Formula
C19H22Cl2O2
SMILES
CC1=C(C=CC(=C1)C(CCl)(CCl)C2=CC(=C(C=C2)OC)C)OC
InChI
InChI=1S/C19H22Cl2O2/c1-13-9-15(5-7-17(13)22-3)19(11-20,12-21)16-6-8-18(23-4)14(2)10-16/h5-10H,11-12H2,1-4H3
InChIKey
GUOLCWNTYYOCQT-UHFFFAOYSA-N
Compound name
4-[1,3-dichloro-2-(4-methoxy-3-methylphenyl)propan-2-yl]-1-methoxy-2-methylbenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

352.09967 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.10695 182.6
[M+Na]+ 375.08889 199.1
[M+NH4]+ 370.13349 191.4
[M+K]+ 391.06283 189.5
[M-H]- 351.09239 187.0
[M+Na-2H]- 373.07434 191.0
[M]+ 352.09912 187.2
[M]- 352.10022 187.2
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.