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THYMOL BLUE (TRIVIAL FORM), ANION
SpectraBase Compound ID 4GjJ3mPV9TO
InChI InChI=1S/C27H32O6S/c1-15(2)19-13-22(17(5)11-24(19)28)27(30,21-9-7-8-10-26(21)34(31,32)33)23-14-20(16(3)4)25(29)12-18(23)6/h7-16,28-30H,1-6H3,(H,31,32,33)/p-1
InChIKey DMDWWRDYKNWBPU-UHFFFAOYSA-M
Mol Weight 483.6 g/mol
Molecular Formula C27H31O6S
Exact Mass 483.184135 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AtsSvl9Us7e
Name THYMOL BLUE (TRIVIAL FORM), ANION
Comments )
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Formula C27H31O6S
InChI InChI=1S/C27H32O6S/c1-15(2)19-13-22(17(5)11-24(19)28)27(30,21-9-7-8-10-26(21)34(31,32)33)23-14-20(16(3)4)25(29)12-18(23)6/h7-16,28-30H,1-6H3,(H,31,32,33)/p-1
InChIKey DMDWWRDYKNWBPU-UHFFFAOYSA-M
Instrument Name Bruker WM-250
Literature Reference A.S.MURAKHOVSKAYA, A.U.STEPANYANTS (1989) Zhurn.Fizich.Khim.(Russ. Lang.): v.63,N11, 3131-3135.
NMR Standard C4H8O2
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent (CD3)2CO/H2O