CID 3023821

Dtxsid801228548

Structural Information

Molecular Formula
C18H20
SMILES
CCC(=C(C1=CC=CC=C1)C2=CC=C(C=C2)C)C
InChI
InChI=1S/C18H20/c1-4-15(3)18(16-8-6-5-7-9-16)17-12-10-14(2)11-13-17/h5-13H,4H2,1-3H3
InChIKey
LNJCJKLAEPHDJQ-UHFFFAOYSA-N
Compound name
1-methyl-4-(2-methyl-1-phenylbut-1-enyl)benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

236.1565 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.163776 156.7
[M+Na]+ 259.145718 162.4
[M-H]- 235.149224 162.9
[M+NH4]+ 254.190323 174.3
[M+K]+ 275.119658 157.9
[M+H-H2O]+ 219.153760 149.4
[M+HCOO]- 281.154701 178.0
[M+CH3COO]- 295.170351 195.5
[M+Na-2H]- 257.131166 159.6
[M]+ 236.15595142 155.6
[M]- 236.15704858 155.6
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.