CID 392607

6,6-bis(p-methoxyphenyl)fulvene

Structural Information

Molecular Formula
C20H18O2
SMILES
COC1=CC=C(C=C1)C(=C2C=CC=C2)C3=CC=C(C=C3)OC
InChI
InChI=1S/C20H18O2/c1-21-18-11-7-16(8-12-18)20(15-5-3-4-6-15)17-9-13-19(22-2)14-10-17/h3-14H,1-2H3
InChIKey
ZTPIYEQWTZQQCA-UHFFFAOYSA-N
Compound name
1-[cyclopenta-2,4-dien-1-ylidene-(4-methoxyphenyl)methyl]-4-methoxybenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

38
Patents

290.13068 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.13796 169.0
[M+Na]+ 313.11990 176.1
[M-H]- 289.12340 179.0
[M+NH4]+ 308.16450 185.9
[M+K]+ 329.09384 171.4
[M+H-H2O]+ 273.12794 160.8
[M+HCOO]- 335.12888 193.2
[M+CH3COO]- 349.14453 201.5
[M+Na-2H]- 311.10535 170.9
[M]+ 290.13013 170.5
[M]- 290.13123 170.5
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.