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(2'S)-2,6-Bis[(1-methoxycarbonyl-3-thiomethyl)propylaminocarbonyl]pyridine
SpectraBase Compound ID A1bn0J6QZaP
InChI InChI=1S/C19H27N3O6S2/c1-27-18(25)14(8-10-29-3)21-16(23)12-6-5-7-13(20-12)17(24)22-15(9-11-30-4)19(26)28-2/h5-7,14-15H,8-11H2,1-4H3,(H,21,23)(H,22,24)/t14-,15-/m0/s1
InChIKey LOBCUYDXDGVJDN-GJZGRUSLSA-N
Mol Weight 457.56 g/mol
Molecular Formula C19H27N3O6S2
Exact Mass 457.134128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BcotPa2Z2jb
Name (2'S)-2,6-Bis[(1-methoxycarbonyl-3-thiomethyl)propylaminocarbonyl]pyridine
Alternate Name(s) Dimethyl 2,2'-((pyridine-2,6-dicarbonyl)bis(azanediyl))(2S,2'S)-bis(4-(methylthio)butanoate)
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Formula C19H27N3O6S2
InChI InChI=1S/C19H27N3O6S2/c1-27-18(25)14(8-10-29-3)21-16(23)12-6-5-7-13(20-12)17(24)22-15(9-11-30-4)19(26)28-2/h5-7,14-15H,8-11H2,1-4H3,(H,21,23)(H,22,24)/t14-,15-/m0/s1
InChIKey LOBCUYDXDGVJDN-GJZGRUSLSA-N
Literature Reference DOI 10.1002_(SICI)1099-0682(199906)1999_6_1001
Molecular Weight 457.560 g/mol
SMILES N([C@@](CCSC)(C(=O)OC)[H])C(c1cccc(C(=O)N[C@](C(OC)=O)(CCSC)[H])n1)=O
SPLASH splash10-01q9-2439100000-6c82300a772f135a87e5
Source of Spectrum U2-1999-1006-7
Wiley ID 1790805