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5H-Pyrano[3,4-b]-1,4-dioxin, acetamide deriv.
SpectraBase Compound ID 8IyNT1bFUYZ
InChI InChI=1S/C14H21NO8/c1-7(16)15-14-13-12(19-4-5-20-13)11(22-9(3)18)10(23-14)6-21-8(2)17/h10-14H,4-6H2,1-3H3,(H,15,16)/t10-,11-,12+,13-,14-/m1/s1
InChIKey MALLEXBCOVHHOL-RKQHYHRCSA-N
Mol Weight 331.32 g/mol
Molecular Formula C14H21NO8
Exact Mass 331.126717 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 56FcZPIsfcQ
Name 5H-Pyrano[3,4-b]-1,4-dioxin, acetamide deriv.
Alternate Name(s) Acetamide, N-[4,6-O-acetyl-2,3-O-1,2-ethanediyl-.beta.-D-glucopyranosyl]- N-acetyl-4,6-di-O-acetyl-2,3-di-O-ethylene-.beta.-D-glucopyranosylamine [(4aR,5R,7R,8R,8aS)-8-(acetyloxy)-5-acetamido-hexahydro-2H-pyrano[3,4-b][1,4]dioxin-7-yl]methyl acetate
CAS Registry Number 125631-29-0
Comments Less than 3 mono-isotopic peaks
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Formula C14H21NO8
InChI InChI=1S/C14H21NO8/c1-7(16)15-14-13-12(19-4-5-20-13)11(22-9(3)18)10(23-14)6-21-8(2)17/h10-14H,4-6H2,1-3H3,(H,15,16)/t10-,11-,12+,13-,14-/m1/s1
InChIKey MALLEXBCOVHHOL-RKQHYHRCSA-N
Molecular Weight 331.321 g/mol
SMILES N([C@]1([C@]2([C@@](OCCO2)([C@@]([C@](O1)(COC(=O)C)[H])(OC(=O)C)[H])[H])[H])[H])C(=O)C
SPLASH splash10-001i-0009000000-236ed1d562976f9ae24f
Source of Spectrum KC-1989-1809-12
Wiley ID 1328527