CID 218446

2-(2-(4-methoxyphenyl)cylopropyl)phenol

Structural Information

Molecular Formula
C16H16O2
SMILES
COC1=CC=C(C=C1)C2CC2C3=CC=CC=C3O
InChI
InChI=1S/C16H16O2/c1-18-12-8-6-11(7-9-12)14-10-15(14)13-4-2-3-5-16(13)17/h2-9,14-15,17H,10H2,1H3
InChIKey
JFHGNQCSVHWAIB-UHFFFAOYSA-N
Compound name
2-[2-(4-methoxyphenyl)cyclopropyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.11504 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.122316 149.4
[M+Na]+ 263.104258 159.2
[M-H]- 239.107764 159.0
[M+NH4]+ 258.148863 161.9
[M+K]+ 279.078198 154.8
[M+H-H2O]+ 223.112300 142.1
[M+HCOO]- 285.113241 172.8
[M+CH3COO]- 299.128891 194.4
[M+Na-2H]- 261.089706 154.6
[M]+ 240.11449142 152.4
[M]- 240.11558858 152.4
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

No patent data available for this compound.