CID 44185415

89778-41-6

Structural Information

Molecular Formula
C22H19ClO
SMILES
C1=CC=C(C=C1)/C(=C(/C2=CC=CC=C2)\C3=CC=C(C=C3)O)/CCCl
InChI
InChI=1S/C22H19ClO/c23-16-15-21(17-7-3-1-4-8-17)22(18-9-5-2-6-10-18)19-11-13-20(24)14-12-19/h1-14,24H,15-16H2/b22-21-
InChIKey
HZPJJMOFPSHKFE-DQRAZIAOSA-N
Compound name
4-[(Z)-4-chloro-1,2-diphenylbut-1-enyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

39
Patents

334.11246 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.11974 179.7
[M+Na]+ 357.10168 185.2
[M-H]- 333.10518 187.0
[M+NH4]+ 352.14628 192.6
[M+K]+ 373.07562 177.1
[M+H-H2O]+ 317.10972 171.3
[M+HCOO]- 379.11066 195.0
[M+CH3COO]- 393.12631 189.4
[M+Na-2H]- 355.08713 181.8
[M]+ 334.11191 179.2
[M]- 334.11301 179.2
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

patents stripe