CID 46309

4,4'-biphenyldiol, 2,2'-dipropyl-

Structural Information

Molecular Formula
C18H22O2
SMILES
CCCC1=C(C=CC(=C1)O)C2=C(C=C(C=C2)O)CCC
InChI
InChI=1S/C18H22O2/c1-3-5-13-11-15(19)7-9-17(13)18-10-8-16(20)12-14(18)6-4-2/h7-12,19-20H,3-6H2,1-2H3
InChIKey
UOZBIIYQAXBZNK-UHFFFAOYSA-N
Compound name
4-(4-hydroxy-2-propylphenyl)-3-propylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

270.162 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.16928 165.6
[M+Na]+ 293.15122 180.3
[M+NH4]+ 288.19582 173.8
[M+K]+ 309.12516 172.0
[M-H]- 269.15472 169.9
[M+Na-2H]- 291.13667 173.3
[M]+ 270.16145 169.0
[M]- 270.16255 169.0
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