CID 103903

P-(1-(p-pentylphenyl)vinyl)anisole

Structural Information

Molecular Formula
C20H24O
SMILES
CCCCCC1=CC=C(C=C1)C(=C)C2=CC=C(C=C2)OC
InChI
InChI=1S/C20H24O/c1-4-5-6-7-17-8-10-18(11-9-17)16(2)19-12-14-20(21-3)15-13-19/h8-15H,2,4-7H2,1,3H3
InChIKey
DFONJTXPBZHBAE-UHFFFAOYSA-N
Compound name
1-methoxy-4-[1-(4-pentylphenyl)ethenyl]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.1827 Da
Monoisotopic Mass

7.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.18998 169.1
[M+Na]+ 303.17192 175.0
[M-H]- 279.17542 175.2
[M+NH4]+ 298.21652 185.1
[M+K]+ 319.14586 170.1
[M+H-H2O]+ 263.17996 161.1
[M+HCOO]- 325.18090 190.9
[M+CH3COO]- 339.19655 204.3
[M+Na-2H]- 301.15737 171.3
[M]+ 280.18215 171.2
[M]- 280.18325 171.2
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

No patent data available for this compound.