CID 6137933

Beta-benzoyl-3,5-di-tert-butyl-4-hydroxystyrene

Structural Information

Molecular Formula
C23H28O2
SMILES
CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)/C=C/C(=O)C2=CC=CC=C2
InChI
InChI=1S/C23H28O2/c1-22(2,3)18-14-16(15-19(21(18)25)23(4,5)6)12-13-20(24)17-10-8-7-9-11-17/h7-15,25H,1-6H3/b13-12+
InChIKey
MQLALXSEENATJA-OUKQBFOZSA-N
Compound name
(E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-phenylprop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

336.20892 Da
Monoisotopic Mass

6.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.21620 185.5
[M+Na]+ 359.19814 198.4
[M+NH4]+ 354.24274 192.2
[M+K]+ 375.17208 191.7
[M-H]- 335.20164 188.1
[M+Na-2H]- 357.18359 192.2
[M]+ 336.20837 188.3
[M]- 336.20947 188.3
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

patents stripe