CID 170923

Benzene, dimethylbis(phenylmethyl)-

Structural Information

Molecular Formula
C22H22
SMILES
CC1=C(C(=C(C=C1)CC2=CC=CC=C2)CC3=CC=CC=C3)C
InChI
InChI=1S/C22H22/c1-17-13-14-21(15-19-9-5-3-6-10-19)22(18(17)2)16-20-11-7-4-8-12-20/h3-14H,15-16H2,1-2H3
InChIKey
WSSNQXJVTQOUMV-UHFFFAOYSA-N
Compound name
1,2-dibenzyl-3,4-dimethylbenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

86
Patents

286.17215 Da
Monoisotopic Mass

6.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.17943 171.5
[M+Na]+ 309.16137 190.1
[M+NH4]+ 304.20597 182.2
[M+K]+ 325.13531 178.4
[M-H]- 285.16487 180.5
[M+Na-2H]- 307.14682 184.7
[M]+ 286.17160 177.3
[M]- 286.17270 177.3
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