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[1,4-Dihydro-1,4-dioxo-8-hydroxy-2-naphthylthio]acetic acid

View entire compound with spectra: 1 Raman, and 3 UV-Vis

[1,4-Dihydro-1,4-dioxo-8-hydroxy-2-naphthylthio]acetic acid
SpectraBase Compound ID 4MuV1eA19oD
InChI InChI=1S/C12H8O5S/c13-7-3-1-2-6-8(14)4-9(12(17)11(6)7)18-5-10(15)16/h1-4,13H,5H2,(H,15,16)
InChIKey QEPWQRSBKMQZQV-UHFFFAOYSA-N
Mol Weight 264.25 g/mol
Molecular Formula C12H8O5S
Exact Mass 264.009245 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID IfEi3XZlfGo
Name [1,4-Dihydro-1,4-dioxo-8-hydroxy-2-naphthylthio]acetic acid
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 264.009244527 u
Formula C12H8O5S
InChI InChI=1S/C12H8O5S/c13-7-3-1-2-6-8(14)4-9(12(17)11(6)7)18-5-10(15)16/h1-4,13H,5H2,(H,15,16)
InChIKey QEPWQRSBKMQZQV-UHFFFAOYSA-N
SMILES OC(CSC=1C(C=2C(=CC=CC2C(C1)=O)O)=O)=O
Spectrum/Structure Validation Score (Raman) 0.966796