CID 414317

9-amino-9h-fluorene-9-sulfonic acid

Structural Information

Molecular Formula
C13H11NO3S
SMILES
C1=CC=C2C(=C1)C3=CC=CC=C3C2(N)S(=O)(=O)O
InChI
InChI=1S/C13H11NO3S/c14-13(18(15,16)17)11-7-3-1-5-9(11)10-6-2-4-8-12(10)13/h1-8H,14H2,(H,15,16,17)
InChIKey
OPHNIIKIKYDSBC-UHFFFAOYSA-N
Compound name
9-aminofluorene-9-sulfonic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.04596 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.05324 155.1
[M+Na]+ 284.03518 166.0
[M-H]- 260.03868 159.6
[M+NH4]+ 279.07978 177.3
[M+K]+ 300.00912 161.0
[M+H-H2O]+ 244.04322 151.0
[M+HCOO]- 306.04416 172.0
[M+CH3COO]- 320.05981 168.1
[M+Na-2H]- 282.02063 162.7
[M]+ 261.04541 157.7
[M]- 261.04651 157.7
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.