CID 66647880

924626-15-3

Structural Information

Molecular Formula
C20H20O3
SMILES
CC1(C2=CC(=C(C=C2C(=O)C1=CC3=CC=CC=C3)OC)OC)C
InChI
InChI=1S/C20H20O3/c1-20(2)15-12-18(23-4)17(22-3)11-14(15)19(21)16(20)10-13-8-6-5-7-9-13/h5-12H,1-4H3
InChIKey
HBYIQDKCUUZHBO-UHFFFAOYSA-N
Compound name
2-benzylidene-5,6-dimethoxy-3,3-dimethylinden-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

560
Patents

308.14124 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.14852 172.5
[M+Na]+ 331.13046 187.0
[M+NH4]+ 326.17506 182.4
[M+K]+ 347.10440 178.5
[M-H]- 307.13396 176.8
[M+Na-2H]- 329.11591 180.2
[M]+ 308.14069 176.1
[M]- 308.14179 176.1
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