CID 21743794

32750-14-4

Structural Information

Molecular Formula
C14H16O2
SMILES
CC1(C=CC=C(C1(O)O)C2=CC=CC=C2)C
InChI
InChI=1S/C14H16O2/c1-13(2)10-6-9-12(14(13,15)16)11-7-4-3-5-8-11/h3-10,15-16H,1-2H3
InChIKey
YKCYZSJMBZVXGN-UHFFFAOYSA-N
Compound name
6,6-dimethyl-2-phenylcyclohexa-2,4-diene-1,1-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

216.11504 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.12232 147.7
[M+Na]+ 239.10426 161.8
[M+NH4]+ 234.14886 159.5
[M+K]+ 255.07820 151.0
[M-H]- 215.10776 151.8
[M+Na-2H]- 237.08971 159.3
[M]+ 216.11449 151.3
[M]- 216.11559 151.3
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.