CID 3631050

31592-24-2

Structural Information

Molecular Formula
C24H28O2
SMILES
CC(C)(C)C1=CC2=C(C=C1)C(=O)C(=CC2(C3=CC=CC=C3)O)C(C)(C)C
InChI
InChI=1S/C24H28O2/c1-22(2,3)17-12-13-18-19(14-17)24(26,16-10-8-7-9-11-16)15-20(21(18)25)23(4,5)6/h7-15,26H,1-6H3
InChIKey
KSTFQNSFBVZBOP-UHFFFAOYSA-N
Compound name
2,6-ditert-butyl-4-hydroxy-4-phenylnaphthalen-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

348.20892 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.216196 186.8
[M+Na]+ 371.198138 194.7
[M-H]- 347.201644 193.3
[M+NH4]+ 366.242743 203.0
[M+K]+ 387.172078 189.7
[M+H-H2O]+ 331.206180 179.9
[M+HCOO]- 393.207121 201.9
[M+CH3COO]- 407.222771 214.5
[M+Na-2H]- 369.183586 191.5
[M]+ 348.20837142 187.7
[M]- 348.20946858 187.7
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.