CID 177033

2,4,6-triphenyl-1-hexene

Structural Information

Molecular Formula
C24H24
SMILES
C=C(CC(CCC1=CC=CC=C1)C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C24H24/c1-20(22-13-7-3-8-14-22)19-24(23-15-9-4-10-16-23)18-17-21-11-5-2-6-12-21/h2-16,24H,1,17-19H2
InChIKey
VTFWGFWAVPVIAA-UHFFFAOYSA-N
Compound name
1,5-diphenylhex-5-en-3-ylbenzene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

5
References

126
Patents

312.1878 Da
Monoisotopic Mass

7.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.19508 178.8
[M+Na]+ 335.17702 182.0
[M-H]- 311.18052 186.8
[M+NH4]+ 330.22162 192.0
[M+K]+ 351.15096 175.3
[M+H-H2O]+ 295.18506 169.1
[M+HCOO]- 357.18600 199.1
[M+CH3COO]- 371.20165 188.3
[M+Na-2H]- 333.16247 181.4
[M]+ 312.18725 176.4
[M]- 312.18835 176.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe