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N-dansyl N-methyl-(methyl)tyrosine
SpectraBase Compound ID IyBOz8oKP3u
InChI InChI=1S/C23H26N2O5S/c1-24(2)19-14-8-13-18-17(19)12-9-15-20(18)31(28,29)25(3)21(23(27)30-4)22(26)16-10-6-5-7-11-16/h5-15,21-22,26H,1-4H3
InChIKey FINIMNQDUJVJGC-UHFFFAOYSA-N
Mol Weight 442.53 g/mol
Molecular Formula C23H26N2O5S
Exact Mass 442.156243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kp6pMpQlBWE
Name N-dansyl N-methyl-(methyl)tyrosine
Alternate Name(s) Methyl 2-[{[5-(dimethylamino)-1-naphthyl]sulfonyl}(methyl)amino]-3-hydroxy-3-phenylpropanoate Methyl N-(5-dimethylaminonaphthalene-1-sulfonyl)-.alpha.-methylamino-.beta.-hydroxyphenylpropanoate
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Formula C23H26N2O5S
InChI InChI=1S/C23H26N2O5S/c1-24(2)19-14-8-13-18-17(19)12-9-15-20(18)31(28,29)25(3)21(23(27)30-4)22(26)16-10-6-5-7-11-16/h5-15,21-22,26H,1-4H3
InChIKey FINIMNQDUJVJGC-UHFFFAOYSA-N
Molecular Weight 442.530 g/mol
SMILES OC(C(N(S(c1c2c(c(N(C)C)ccc2)ccc1)(=O)=O)C)C(=O)OC)c1ccccc1
SPLASH splash10-05fr-0900200000-05fdc48ed2bc8ef76481
Source of Spectrum KO-14-2-0
Wiley ID 1385272