CID 80715

6362-80-7

Structural Information

Molecular Formula
C18H20
SMILES
CC(C)(CC(=C)C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C18H20/c1-15(16-10-6-4-7-11-16)14-18(2,3)17-12-8-5-9-13-17/h4-13H,1,14H2,2-3H3
InChIKey
ZOKCNEIWFQCSCM-UHFFFAOYSA-N
Compound name
(2-methyl-4-phenylpent-4-en-2-yl)benzene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

3
References

7080
Patents

236.1565 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.16378 158.5
[M+Na]+ 259.14572 173.2
[M+NH4]+ 254.19032 168.1
[M+K]+ 275.11966 164.4
[M-H]- 235.14922 163.6
[M+Na-2H]- 257.13117 168.8
[M]+ 236.15595 162.4
[M]- 236.15705 162.4
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