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D-Glucose, 6-O-(methoxyphenylmethyl)-, diethyl mercaptal
SpectraBase Compound ID HARpiTf6YmP
InChI InChI=1S/C18H30O6S2/c1-4-25-18(26-5-2)16(22)15(21)14(20)13(19)11-24-17(23-3)12-9-7-6-8-10-12/h6-10,13-22H,4-5,11H2,1-3H3/t13-,14-,15+,16-,17?/m1/s1
InChIKey AUBPPHGEVYSQBL-VDWCLKJHSA-N
Mol Weight 406.55 g/mol
Molecular Formula C18H30O6S2
Exact Mass 406.148381 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A8CgqQJvunl
Name D-Glucose, 6-O-(methoxyphenylmethyl)-, diethyl mercaptal
CAS Registry Number 106450-86-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H30O6S2
InChI InChI=1S/C18H30O6S2/c1-4-25-18(26-5-2)16(22)15(21)14(20)13(19)11-24-17(23-3)12-9-7-6-8-10-12/h6-10,13-22H,4-5,11H2,1-3H3/t13-,14-,15+,16-,17?/m1/s1
InChIKey AUBPPHGEVYSQBL-VDWCLKJHSA-N
Molecular Weight 406.552 g/mol
SMILES O[C@]([C@]([C@@]([C@@](COC(c1ccccc1)OC)(O)[H])(O)[H])(O)[H])(C(SCC)SCC)[H]
SPLASH splash10-0079-0911000000-c8406caaaac6da3ad39e
Source of Spectrum I-64-2395-5
Synonyms ({[(2R,3R,4S,5R)-6,6-bis(ethylsulfanyl)-2,3,4,5-tetrahydroxyhexyl]oxy}(methoxy)methyl)benzene 6-O-(methoxyphenylmethyl)-D-glucose diethyl dithioacetal
Wiley ID 1371985