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N-METHOXYTHIOCARBONYL-4-(ALPHA-L-RHAMNOPYRANOSYLOXY)-BENZYLAMINE;NIAZININ;MIXTURES_OF_ISOMERS
SpectraBase Compound ID 7GtKK6FKQAb
InChI InChI=1S/2C15H21NO6S/c2*1-8-11(17)12(18)13(19)14(21-8)22-10-5-3-9(4-6-10)7-16-15(23)20-2/h2*3-6,8,11-14,17-19H,7H2,1-2H3,(H,16,23)/t2*8-,11-,12+,13+,14-/m11/s1
InChIKey MQWPWNAFSMSELZ-ALAQQHNHSA-N
Mol Weight 686.79 g/mol
Molecular Formula C30H42N2O12S2
Exact Mass 686.217917 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1vUPrdPiV36
Name N-METHOXYTHIOCARBONYL-4-(ALPHA-L-RHAMNOPYRANOSYLOXY)-BENZYLAMINE;NIAZININ;MIXTURES_OF_ISOMERS
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H42N2O12S2
InChI InChI=1S/2C15H21NO6S/c2*1-8-11(17)12(18)13(19)14(21-8)22-10-5-3-9(4-6-10)7-16-15(23)20-2/h2*3-6,8,11-14,17-19H,7H2,1-2H3,(H,16,23)/t2*8-,11-,12+,13+,14-/m11/s1
InChIKey MQWPWNAFSMSELZ-ALAQQHNHSA-N
Literature Reference Author M.LEUCK,H.KUNZ
Literature Reference Citation CARBOHYDR.RES.,312,33(1998)
Literature Reference DOI 10.1016/S0008-6215(98)00223-7
Molecular Weight 686.790 g/mol
Solvent DMSO-D6