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N-dansyl-methylleucine
SpectraBase Compound ID muWmqBe2JP
InChI InChI=1S/C19H26N2O4S/c1-13(2)12-16(19(22)25-5)20-26(23,24)18-11-7-8-14-15(18)9-6-10-17(14)21(3)4/h6-11,13,16,20H,12H2,1-5H3
InChIKey HXCMYJDUVOQZNI-UHFFFAOYSA-N
Mol Weight 378.49 g/mol
Molecular Formula C19H26N2O4S
Exact Mass 378.161328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CoKek3lOjjt
Name N-dansyl-methylleucine
Alternate Name(s) Methyl 2-({[5-(dimethylamino)-1-naphthyl]sulfonyl}amino)-4-methylpentanoate Methyl N-(5-dimethylaminonaphthalene-1-sulfonyl)-2-amino-4-methylpentanoate
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Formula C19H26N2O4S
InChI InChI=1S/C19H26N2O4S/c1-13(2)12-16(19(22)25-5)20-26(23,24)18-11-7-8-14-15(18)9-6-10-17(14)21(3)4/h6-11,13,16,20H,12H2,1-5H3
InChIKey HXCMYJDUVOQZNI-UHFFFAOYSA-N
Molecular Weight 378.487 g/mol
SMILES N(S(c1c2c(c(N(C)C)ccc2)ccc1)(=O)=O)C(C(=O)OC)CC(C)C
SPLASH splash10-00i0-0809000000-adb8d6d7bfe27fdb47fc
Source of Spectrum KO-14-2-0
Wiley ID 1358660