CID 139597297

Dtxsid601232876

Structural Information

Molecular Formula
C22H19ClO
SMILES
C1=CC=C(C=C1)C=C(C2=CC=CC=C2)C3=CC=C(C=C3)OCCCl
InChI
InChI=1S/C22H19ClO/c23-15-16-24-21-13-11-20(12-14-21)22(19-9-5-2-6-10-19)17-18-7-3-1-4-8-18/h1-14,17H,15-16H2
InChIKey
UITSHJJSIRKGFR-UHFFFAOYSA-N
Compound name
1-(2-chloroethoxy)-4-(1,2-diphenylethenyl)benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

334.11246 Da
Monoisotopic Mass

6.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.11974 180.4
[M+Na]+ 357.10168 186.6
[M-H]- 333.10518 188.9
[M+NH4]+ 352.14628 194.1
[M+K]+ 373.07562 178.8
[M+H-H2O]+ 317.10972 171.4
[M+HCOO]- 379.11066 198.1
[M+CH3COO]- 393.12631 190.8
[M+Na-2H]- 355.08713 183.9
[M]+ 334.11191 182.2
[M]- 334.11301 182.2
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.