CID 46319

63992-39-2

Structural Information

Molecular Formula
C18H18O2
SMILES
C=CCC1=C(C=CC(=C1)O)C2=C(C=C(C=C2)O)CC=C
InChI
InChI=1S/C18H18O2/c1-3-5-13-11-15(19)7-9-17(13)18-10-8-16(20)12-14(18)6-4-2/h3-4,7-12,19-20H,1-2,5-6H2
InChIKey
SQTKAXOZBSHYIE-UHFFFAOYSA-N
Compound name
4-(4-hydroxy-2-prop-2-enylphenyl)-3-prop-2-enylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

266.13068 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.13796 163.9
[M+Na]+ 289.11990 178.7
[M+NH4]+ 284.16450 171.5
[M+K]+ 305.09384 170.1
[M-H]- 265.12340 167.6
[M+Na-2H]- 287.10535 171.4
[M]+ 266.13013 167.1
[M]- 266.13123 167.1
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