CID 1382789

4'-methyl[1,1'-biphenyl]-4-ol

Structural Information

Molecular Formula
C13H12O
SMILES
CC1=CC=C(C=C1)C2=CC=C(C=C2)O
InChI
InChI=1S/C13H12O/c1-10-2-4-11(5-3-10)12-6-8-13(14)9-7-12/h2-9,14H,1H3
InChIKey
DDZACMDGXVXOOH-UHFFFAOYSA-N
Compound name
4-(4-methylphenyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1099
Patents

184.08882 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.09610 138.0
[M+Na]+ 207.07804 146.6
[M-H]- 183.08154 144.0
[M+NH4]+ 202.12264 157.4
[M+K]+ 223.05198 142.7
[M+H-H2O]+ 167.08608 131.7
[M+HCOO]- 229.08702 161.6
[M+CH3COO]- 243.10267 180.7
[M+Na-2H]- 205.06349 144.9
[M]+ 184.08827 137.1
[M]- 184.08937 137.1
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