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Chloro-tetracycline cation
SpectraBase Compound ID 2dSADRo3vmp
InChI InChI=1S/C22H23ClN2O8/c1-21(32)7-6-8-15(25(2)3)17(28)13(20(24)31)19(30)22(8,33)18(29)11(7)16(27)12-10(26)5-4-9(23)14(12)21/h4-5,7-8,15,26,28-29,32-33H,6H2,1-3H3,(H2,24,31)/p+1
InChIKey CYDMQBQPVICBEU-UHFFFAOYSA-O
Mol Weight 479.89 g/mol
Molecular Formula C22H24ClN2O8
Exact Mass 479.122118 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4WerdMZsKoL
Name Chloro-tetracycline cation
Comments SIGNALS BETWEEN 37 AND 42 PPM ARE OBSCURED BY THE DMSO SOLVENT, THUS PPM VALUES GIVEN ARE ONLY ESTIMATES HYDROCHLORID
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Formula C22H24ClN2O8
InChI InChI=1S/C22H23ClN2O8/c1-21(32)7-6-8-15(25(2)3)17(28)13(20(24)31)19(30)22(8,33)18(29)11(7)16(27)12-10(26)5-4-9(23)14(12)21/h4-5,7-8,15,26,28-29,32-33H,6H2,1-3H3,(H2,24,31)/p+1
InChIKey CYDMQBQPVICBEU-UHFFFAOYSA-O
Instrument Name Bruker HX-90
Literature Reference G.L. Aleson, C.W. Frank, J. Am. Chem. Soc. 97, 6246 (1975).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6