CID 131667466

1-(2-chloro-1,2-diphenylethenyl)-4-(2-chloroethoxy)benzene

Structural Information

Molecular Formula
C22H18Cl2O
SMILES
C1=CC=C(C=C1)C(=C(C2=CC=CC=C2)Cl)C3=CC=C(C=C3)OCCCl
InChI
InChI=1S/C22H18Cl2O/c23-15-16-25-20-13-11-18(12-14-20)21(17-7-3-1-4-8-17)22(24)19-9-5-2-6-10-19/h1-14H,15-16H2
InChIKey
UWRMGGWAVBMGAW-UHFFFAOYSA-N
Compound name
1-(2-chloro-1,2-diphenylethenyl)-4-(2-chloroethoxy)benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

368.07346 Da
Monoisotopic Mass

7.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 369.08074 185.5
[M+Na]+ 391.06268 191.9
[M-H]- 367.06618 193.2
[M+NH4]+ 386.10728 198.2
[M+K]+ 407.03662 183.5
[M+H-H2O]+ 351.07072 177.1
[M+HCOO]- 413.07166 197.2
[M+CH3COO]- 427.08731 195.0
[M+Na-2H]- 389.04813 187.2
[M]+ 368.07291 188.4
[M]- 368.07401 188.4
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.