CID 102724

Phenol, 4,4'-(octahydro-4,7-methano-5h-inden-5-ylidene)bis-

Structural Information

Molecular Formula
C22H24O2
SMILES
C1CC2C(C1)C3CC2CC3(C4=CC=C(C=C4)O)C5=CC=C(C=C5)O
InChI
InChI=1S/C22H24O2/c23-17-8-4-15(5-9-17)22(16-6-10-18(24)11-7-16)13-14-12-21(22)20-3-1-2-19(14)20/h4-11,14,19-21,23-24H,1-3,12-13H2
InChIKey
WWCSTJWKTAXUGJ-UHFFFAOYSA-N
Compound name
4-[8-(4-hydroxyphenyl)-8-tricyclo[5.2.1.02,6]decanyl]phenol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

4
References

657
Patents

320.17764 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.18492 178.1
[M+Na]+ 343.16686 185.0
[M-H]- 319.17036 186.3
[M+NH4]+ 338.21146 200.8
[M+K]+ 359.14080 178.0
[M+H-H2O]+ 303.17490 173.1
[M+HCOO]- 365.17584 194.6
[M+CH3COO]- 379.19149 188.8
[M+Na-2H]- 341.15231 175.9
[M]+ 320.17709 175.0
[M]- 320.17819 175.0
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