CID 109379

4,6-dimethyl-2,4,6,8-tetraphenyl-1-nonene

Structural Information

Molecular Formula
C35H38
SMILES
CC(CC(C)(CC(C)(CC(=C)C1=CC=CC=C1)C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C35H38/c1-28(30-17-9-5-10-18-30)25-34(3,32-21-13-7-14-22-32)27-35(4,33-23-15-8-16-24-33)26-29(2)31-19-11-6-12-20-31/h5-24,29H,1,25-27H2,2-4H3
InChIKey
OHRNENNJMYUUOA-UHFFFAOYSA-N
Compound name
(4,6-dimethyl-2,6,8-triphenylnon-1-en-4-yl)benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

458.29736 Da
Monoisotopic Mass

11.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 459.30464 219.2
[M+Na]+ 481.28658 219.3
[M-H]- 457.29008 228.7
[M+NH4]+ 476.33118 225.5
[M+K]+ 497.26052 211.1
[M+H-H2O]+ 441.29462 207.3
[M+HCOO]- 503.29556 233.2
[M+CH3COO]- 517.31121 237.5
[M+Na-2H]- 479.27203 219.7
[M]+ 458.29681 216.4
[M]- 458.29791 216.4
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.