CID 3086614

1,3-bis(1-(methylphenyl)ethenyl)benzene

Structural Information

Molecular Formula
C24H22
SMILES
CC1=CC=CC=C1C(=C)C2=CC(=CC=C2)C(=C)C3=CC=CC=C3C
InChI
InChI=1S/C24H22/c1-17-10-5-7-14-23(17)19(3)21-12-9-13-22(16-21)20(4)24-15-8-6-11-18(24)2/h5-16H,3-4H2,1-2H3
InChIKey
BPOKXOUKXFUPBU-UHFFFAOYSA-N
Compound name
1,3-bis[1-(2-methylphenyl)ethenyl]benzene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

2
Patents

310.17215 Da
Monoisotopic Mass

8.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.17943 175.9
[M+Na]+ 333.16137 182.2
[M-H]- 309.16487 185.2
[M+NH4]+ 328.20597 190.1
[M+K]+ 349.13531 175.2
[M+H-H2O]+ 293.16941 166.8
[M+HCOO]- 355.17035 196.4
[M+CH3COO]- 369.18600 211.4
[M+Na-2H]- 331.14682 176.4
[M]+ 310.17160 174.2
[M]- 310.17270 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