CID 17578

2668-47-5

Structural Information

Molecular Formula
C20H26O
SMILES
CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2=CC=CC=C2
InChI
InChI=1S/C20H26O/c1-19(2,3)16-12-15(14-10-8-7-9-11-14)13-17(18(16)21)20(4,5)6/h7-13,21H,1-6H3
InChIKey
JIEWQZNTUPWNMX-UHFFFAOYSA-N
Compound name
2,6-ditert-butyl-4-phenylphenol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

817
Patents

282.19836 Da
Monoisotopic Mass

6.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.20564 168.9
[M+Na]+ 305.18758 176.4
[M-H]- 281.19108 174.8
[M+NH4]+ 300.23218 185.1
[M+K]+ 321.16152 172.1
[M+H-H2O]+ 265.19562 162.7
[M+HCOO]- 327.19656 186.9
[M+CH3COO]- 341.21221 202.6
[M+Na-2H]- 303.17303 173.0
[M]+ 282.19781 169.9
[M]- 282.19891 169.9
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