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Cresol red
SpectraBase Compound ID 9tkY4HbXmuR
InChI InChI=1S/C21H18O5S/c1-13-11-15(7-9-18(13)22)21(16-8-10-19(23)14(2)12-16)17-5-3-4-6-20(17)27(24,25)26-21/h3-12,22-23H,1-2H3
InChIKey OBRMNDMBJQTZHV-UHFFFAOYSA-N
Mol Weight 382.43 g/mol
Molecular Formula C21H18O5S
Exact Mass 382.087495 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FvJZwvQRPgP
Name 4,4'-(3H-2,1-BENZOXATHIOL-3-YLIDENE)DI-o-CRESOL, S,S-DIOXIDE
Source of Sample Fluka AG, Buchs, Switzerland
CAS Registry Number 1733-12-6
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18O5S
InChI InChI=1S/C21H18O5S/c1-13-11-15(7-9-18(13)22)21(16-8-10-19(23)14(2)12-16)17-5-3-4-6-20(17)27(24,25)26-21/h3-12,22-23H,1-2H3
InChIKey OBRMNDMBJQTZHV-UHFFFAOYSA-N
Molecular Weight 382.44
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20