CID 57157900

2468315-70-8

Structural Information

Molecular Formula
C22H28
SMILES
CC(C)(C)C1=CC=C(C=C1)C=CC2=CC=C(C=C2)C(C)(C)C
InChI
InChI=1S/C22H28/c1-21(2,3)19-13-9-17(10-14-19)7-8-18-11-15-20(16-12-18)22(4,5)6/h7-16H,1-6H3
InChIKey
XTJKJVFXJGERSP-UHFFFAOYSA-N
Compound name
1-tert-butyl-4-[2-(4-tert-butylphenyl)ethenyl]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

292.2191 Da
Monoisotopic Mass

7.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.22638 173.3
[M+Na]+ 315.20832 180.0
[M-H]- 291.21182 179.9
[M+NH4]+ 310.25292 189.6
[M+K]+ 331.18226 174.7
[M+H-H2O]+ 275.21636 166.4
[M+HCOO]- 337.21730 192.2
[M+CH3COO]- 351.23295 206.4
[M+Na-2H]- 313.19377 177.4
[M]+ 292.21855 174.2
[M]- 292.21965 174.2
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