CID 2136111

Di(2-naphthyl) 9h-fluorene-2,7-disulfonate

Structural Information

Molecular Formula
C33H22O6S2
SMILES
C1C2=C(C=CC(=C2)S(=O)(=O)OC3=CC4=CC=CC=C4C=C3)C5=C1C=C(C=C5)S(=O)(=O)OC6=CC7=CC=CC=C7C=C6
InChI
InChI=1S/C33H22O6S2/c34-40(35,38-28-11-9-22-5-1-3-7-24(22)18-28)30-13-15-32-26(20-30)17-27-21-31(14-16-33(27)32)41(36,37)39-29-12-10-23-6-2-4-8-25(23)19-29/h1-16,18-21H,17H2
InChIKey
QPIDGTGWEVZKLO-UHFFFAOYSA-N
Compound name
dinaphthalen-2-yl 9H-fluorene-2,7-disulfonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

578.08575 Da
Monoisotopic Mass

8.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 579.09303 237.8
[M+Na]+ 601.07497 246.8
[M-H]- 577.07847 249.8
[M+NH4]+ 596.11957 246.4
[M+K]+ 617.04891 241.4
[M+H-H2O]+ 561.08301 229.0
[M+HCOO]- 623.08395 246.4
[M+CH3COO]- 637.09960 244.8
[M+Na-2H]- 599.06042 246.2
[M]+ 578.08520 246.8
[M]- 578.08630 246.8
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