CID 3292100

1,3-bis[2-(4-hydroxyphenyl)-2-propyl]benzene

Structural Information

Molecular Formula
C24H26O2
SMILES
CC(C)(C1=CC=C(C=C1)O)C2=CC(=CC=C2)C(C)(C)C3=CC=C(C=C3)O
InChI
InChI=1S/C24H26O2/c1-23(2,17-8-12-21(25)13-9-17)19-6-5-7-20(16-19)24(3,4)18-10-14-22(26)15-11-18/h5-16,25-26H,1-4H3
InChIKey
PVFQHGDIOXNKIC-UHFFFAOYSA-N
Compound name
4-[2-[3-[2-(4-hydroxyphenyl)propan-2-yl]phenyl]propan-2-yl]phenol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

1
References

15865
Patents

346.19327 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 347.20055 185.4
[M+Na]+ 369.18249 191.4
[M-H]- 345.18599 192.5
[M+NH4]+ 364.22709 197.1
[M+K]+ 385.15643 185.6
[M+H-H2O]+ 329.19053 177.3
[M+HCOO]- 391.19147 201.7
[M+CH3COO]- 405.20712 211.4
[M+Na-2H]- 367.16794 189.3
[M]+ 346.19272 184.6
[M]- 346.19382 184.6
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