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1,3,4,5-tetra-O-acetyl-1-deuterio-2-O-methyl-L-arabinitol
SpectraBase Compound ID HmXe5XJGgty
InChI InChI=1S/C14H22O9/c1-8(15)20-6-12(19-5)14(23-11(4)18)13(22-10(3)17)7-21-9(2)16/h12-14H,6-7H2,1-5H3/t12-,13-,14+/m0/s1/i6D/t6?,12-,13-,14+
InChIKey MJLMKAVCETZHPI-DBJSCERYSA-N
Mol Weight 335.33 g/mol
Molecular Formula C14H21DO9
Exact Mass 335.132659 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JvYPQAal3kB
Name 1,3,4,5-tetra-O-acetyl-1-deuterio-2-O-methyl-L-arabinitol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.132659025 u
Formula C14H21DO9
InChI InChI=1S/C14H22O9/c1-8(15)20-6-12(19-5)14(23-11(4)18)13(22-10(3)17)7-21-9(2)16/h12-14H,6-7H2,1-5H3/t12-,13-,14+/m0/s1/i6D/t6?,12-,13-,14+
InChIKey MJLMKAVCETZHPI-DBJSCERYSA-N
Instrument Name Agilent 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1016/j.arabjc.2022.104132
Molecular Weight 335.327 g/mol
Quality 465
SMILES C(OC([C@@]([C@]([C@@](OC(C)=O)(COC(C)=O)[H])(OC(C)=O)[H])(OC)[H])[D])(=O)C
SPLASH splash10-014i-2900000000-383df9a3346ecdcd2c00
Source of Spectrum AJC-15-SM12-Fig. S5-C (DOI: 10.1016/j.arabjc.2022.104132)
Wiley ID 1908020