CID 63063

68684-63-9

Structural Information

Molecular Formula
C22H20O
SMILES
CCC(=C(C1=CC=CC=C1)C2=CC=C(C=C2)O)C3=CC=CC=C3
InChI
InChI=1S/C22H20O/c1-2-21(17-9-5-3-6-10-17)22(18-11-7-4-8-12-18)19-13-15-20(23)16-14-19/h3-16,23H,2H2,1H3
InChIKey
YJVFSITVRZYTHO-UHFFFAOYSA-N
Compound name
4-(1,2-diphenylbut-1-enyl)phenol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

8
References

48
Patents

300.15143 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.15871 174.8
[M+Na]+ 323.14065 190.9
[M+NH4]+ 318.18525 184.0
[M+K]+ 339.11459 181.2
[M-H]- 299.14415 182.0
[M+Na-2H]- 321.12610 186.5
[M]+ 300.15088 179.4
[M]- 300.15198 179.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe