CID 6441620

40470-68-6

Structural Information

Molecular Formula
C30H26O2
SMILES
COC1=CC=CC=C1/C=C/C2=CC=C(C=C2)C3=CC=C(C=C3)/C=C/C4=CC=CC=C4OC
InChI
InChI=1S/C30H26O2/c1-31-29-9-5-3-7-27(29)21-15-23-11-17-25(18-12-23)26-19-13-24(14-20-26)16-22-28-8-4-6-10-30(28)32-2/h3-22H,1-2H3/b21-15+,22-16+
InChIKey
HZAWHDJKNZWAAR-YHARCJFQSA-N
Compound name
1-methoxy-2-[(E)-2-[4-[4-[(E)-2-(2-methoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]benzene
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

275
Patents

418.19327 Da
Monoisotopic Mass

8.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 419.20055 207.9
[M+Na]+ 441.18249 214.0
[M-H]- 417.18599 219.6
[M+NH4]+ 436.22709 217.1
[M+K]+ 457.15643 205.7
[M+H-H2O]+ 401.19053 195.7
[M+HCOO]- 463.19147 229.5
[M+CH3COO]- 477.20712 216.7
[M+Na-2H]- 439.16794 208.6
[M]+ 418.19272 209.1
[M]- 418.19382 209.1
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

patents stripe