CID 355994

1176-09-6

Structural Information

Molecular Formula
C28H18O2
SMILES
C1=CC=C2C(=C1)C3=CC=CC=C3C2(C=O)C4(C5=CC=CC=C5C6=CC=CC=C64)C=O
InChI
InChI=1S/C28H18O2/c29-17-27(23-13-5-1-9-19(23)20-10-2-6-14-24(20)27)28(18-30)25-15-7-3-11-21(25)22-12-4-8-16-26(22)28/h1-18H
InChIKey
GLANOOJJBKXTMI-UHFFFAOYSA-N
Compound name
9-(9-formylfluoren-9-yl)fluorene-9-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

122
Patents

386.13068 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 387.13796 197.9
[M+Na]+ 409.11990 209.6
[M-H]- 385.12340 209.2
[M+NH4]+ 404.16450 220.2
[M+K]+ 425.09384 200.0
[M+H-H2O]+ 369.12794 188.0
[M+HCOO]- 431.12888 218.0
[M+CH3COO]- 445.14453 209.2
[M+Na-2H]- 407.10535 201.4
[M]+ 386.13013 201.1
[M]- 386.13123 201.1
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

No patent data available for this compound.