CID 93344

63428-98-8

Structural Information

Molecular Formula
C22H30O
SMILES
CC(C1=CC=CC=C1)C2=C(C(=CC(=C2)C(C)(C)C)C(C)(C)C)O
InChI
InChI=1S/C22H30O/c1-15(16-11-9-8-10-12-16)18-13-17(21(2,3)4)14-19(20(18)23)22(5,6)7/h8-15,23H,1-7H3
InChIKey
XOVCWYXPFJNQLU-UHFFFAOYSA-N
Compound name
2,4-ditert-butyl-6-(1-phenylethyl)phenol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

32
Patents

310.22968 Da
Monoisotopic Mass

7.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.23696 180.3
[M+Na]+ 333.21890 193.8
[M+NH4]+ 328.26350 188.3
[M+K]+ 349.19284 186.9
[M-H]- 309.22240 184.0
[M+Na-2H]- 331.20435 187.9
[M]+ 310.22913 183.7
[M]- 310.23023 183.7
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