CID 73996

4-methoxy-2,6-dimethylphenol

Structural Information

Molecular Formula
C9H12O2
SMILES
CC1=CC(=CC(=C1O)C)OC
InChI
InChI=1S/C9H12O2/c1-6-4-8(11-3)5-7(2)9(6)10/h4-5,10H,1-3H3
InChIKey
UCHRDYUBDZOFBJ-UHFFFAOYSA-N
Compound name
4-methoxy-2,6-dimethylphenol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

83
Patents

152.08372 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.09100 129.7
[M+Na]+ 175.07294 143.4
[M+NH4]+ 170.11754 138.6
[M+K]+ 191.04688 137.3
[M-H]- 151.07644 131.9
[M+Na-2H]- 173.05839 136.5
[M]+ 152.08317 132.3
[M]- 152.08427 132.3
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