CID 172909659

Fluorescein isothiocyanate-dextran

Structural Information

Molecular Formula
C21H13NO6S
SMILES
C1=CC=C2C(=C1)C(=O)OC23C4=C(C=C(C=C4)O)OC5=C3C=CC(=C5)ONC(=O)S
InChI
InChI=1S/C21H13NO6S/c23-11-5-7-15-17(9-11)26-18-10-12(28-22-20(25)29)6-8-16(18)21(15)14-4-2-1-3-13(14)19(24)27-21/h1-10,23H,(H2,22,25,29)
InChIKey
PUQQBNGWUKSTLB-UHFFFAOYSA-N
Compound name
(6'-hydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl)oxycarbamothioic S-acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

407.04636 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 408.05364 186.9
[M+Na]+ 430.03558 196.9
[M-H]- 406.03908 195.9
[M+NH4]+ 425.08018 201.7
[M+K]+ 446.00952 194.9
[M+H-H2O]+ 390.04362 180.6
[M+HCOO]- 452.04456 199.3
[M+CH3COO]- 466.06021 197.7
[M+Na-2H]- 428.02103 193.8
[M]+ 407.04581 193.8
[M]- 407.04691 193.8
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

No patent data available for this compound.