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[(7-oxo-7H-benz[de]anthracen-3-yl)thio]acetic acid

View entire compound with spectra: 2 NMR, and 1 FTIR

[(7-oxo-7H-benz[de]anthracen-3-yl)thio]acetic acid
SpectraBase Compound ID 9MRl03yLeSB
InChI InChI=1S/C19H12O3S/c20-17(21)10-23-16-9-8-12-11-4-1-2-5-13(11)19(22)15-7-3-6-14(16)18(12)15/h1-9H,10H2,(H,20,21)
InChIKey QQRGUQLAJOQLIW-UHFFFAOYSA-N
Mol Weight 320.36 g/mol
Molecular Formula C19H12O3S
Exact Mass 320.050715 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1oy58FEUGbM
Name [(7-OXO-7H-BENZ[de]ANTHRACEN-3-YL)THIO]ACETIC ACID
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Comments Some carbon atoms are unassigned
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H12O3S
InChI InChI=1S/C19H12O3S/c20-17(21)10-23-16-9-8-12-11-4-1-2-5-13(11)19(22)15-7-3-6-14(16)18(12)15/h1-9H,10H2,(H,20,21)
InChIKey QQRGUQLAJOQLIW-UHFFFAOYSA-N
Molecular Weight 320.37
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms ACETIC ACID, //7-OXO-7H-BENZ/DE/ANTHRACEN-3-YL/THIO/-,