CID 1378002

31060-60-3

Structural Information

Molecular Formula
C24H14O2
SMILES
C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C=C4C(=O)C5=CC=CC=C5C4=O
InChI
InChI=1S/C24H14O2/c25-23-19-11-5-6-12-20(19)24(26)22(23)14-21-17-9-3-1-7-15(17)13-16-8-2-4-10-18(16)21/h1-14H
InChIKey
ZUYDSJGRTZFYOT-UHFFFAOYSA-N
Compound name
2-(anthracen-9-ylmethylidene)indene-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

334.09937 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.10665 178.7
[M+Na]+ 357.08859 189.9
[M-H]- 333.09209 189.0
[M+NH4]+ 352.13319 197.1
[M+K]+ 373.06253 181.5
[M+H-H2O]+ 317.09663 170.2
[M+HCOO]- 379.09757 200.1
[M+CH3COO]- 393.11322 190.9
[M+Na-2H]- 355.07404 183.2
[M]+ 334.09882 180.3
[M]- 334.09992 180.3
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.