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1-(2,3,4,6-Tetra-O-acetyl-.beta.,D-galactopyranosyl)-4-methylsulfanyl-1,3,5-triazine-2(1H)-thione
SpectraBase Compound ID 3sUSGaRTUAY
InChI InChI=1S/C18H23N3O9S2/c1-8(22)26-6-12-13(27-9(2)23)14(28-10(3)24)15(29-11(4)25)16(30-12)21-7-19-17(32-5)20-18(21)31/h7,12-16H,6H2,1-5H3/t12-,13+,14+,15-,16-/m1/s1
InChIKey NOLOLLVUPVLKTM-LYYZXLFJSA-N
Mol Weight 489.51 g/mol
Molecular Formula C18H23N3O9S2
Exact Mass 489.087572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BSiIgPiOQAN
Name 1-(2,3,4,6-Tetra-O-acetyl-.beta.,D-galactopyranosyl)-4-methylsulfanyl-1,3,5-triazine-2(1H)-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23N3O9S2
InChI InChI=1S/C18H23N3O9S2/c1-8(22)26-6-12-13(27-9(2)23)14(28-10(3)24)15(29-11(4)25)16(30-12)21-7-19-17(32-5)20-18(21)31/h7,12-16H,6H2,1-5H3/t12-,13+,14+,15-,16-/m1/s1
InChIKey NOLOLLVUPVLKTM-LYYZXLFJSA-N
Molecular Weight 489.514 g/mol
SMILES [C@@]1(N2C(N=C(N=C2)SC)=S)([C@@]([C@@](OC(=O)C)([C@]([C@](O1)(COC(=O)C)[H])(OC(=O)C)[H])[H])(OC(=O)C)[H])[H]
SPLASH splash10-0006-9310000000-244459bc0aa72f2d0f6f
Source of Spectrum F4-40-3456-5b
Wiley ID 1671324