CID 131752398

3-methoxy-4-prenylstilbene

Structural Information

Molecular Formula
C20H22O
SMILES
CC(=CCC1=C(C=C(C=C1)/C=C\C2=CC=CC=C2)OC)C
InChI
InChI=1S/C20H22O/c1-16(2)9-13-19-14-12-18(15-20(19)21-3)11-10-17-7-5-4-6-8-17/h4-12,14-15H,13H2,1-3H3/b11-10-
InChIKey
HPQIYBHUJSJOMV-KHPPLWFESA-N
Compound name
2-methoxy-1-(3-methylbut-2-enyl)-4-[(Z)-2-phenylethenyl]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

278.16705 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.17433 168.1
[M+Na]+ 301.15627 174.5
[M-H]- 277.15977 174.4
[M+NH4]+ 296.20087 184.3
[M+K]+ 317.13021 169.1
[M+H-H2O]+ 261.16431 160.3
[M+HCOO]- 323.16525 190.2
[M+CH3COO]- 337.18090 202.2
[M+Na-2H]- 299.14172 170.3
[M]+ 278.16650 169.3
[M]- 278.16760 169.3
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.