CID 131752881

1-methoxy-4-[6-methyl-4-(2-methyl-1-propenyl)-1,5,7-octatrienyl]benzene, 9ci

Structural Information

Molecular Formula
C20H26O
SMILES
CC(=CC(C/C=C\C1=CC=C(C=C1)OC)/C=C(/C)\C=C)C
InChI
InChI=1S/C20H26O/c1-6-17(4)15-19(14-16(2)3)9-7-8-18-10-12-20(21-5)13-11-18/h6-8,10-15,19H,1,9H2,2-5H3/b8-7-,17-15-
InChIKey
FNNVIJKTAGXPFS-DMMNKWGDSA-N
Compound name
1-methoxy-4-[(1Z,5Z)-6-methyl-4-(2-methylprop-1-enyl)octa-1,5,7-trienyl]benzene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

282.19836 Da
Monoisotopic Mass

6.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.20564 173.6
[M+Na]+ 305.18758 184.5
[M+NH4]+ 300.23218 180.0
[M+K]+ 321.16152 176.5
[M-H]- 281.19108 174.6
[M+Na-2H]- 303.17303 177.3
[M]+ 282.19781 175.2
[M]- 282.19891 175.2
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

No patent data available for this compound.