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(2S,3S,4R)-1-(benzyloxy)-2,3-bis[(methoxymethyl)oxy]-4-heptanol
SpectraBase Compound ID Ch7X5n0NTdm
InChI InChI=1S/C18H30O6/c1-4-8-16(19)18(24-14-21-3)17(23-13-20-2)12-22-11-15-9-6-5-7-10-15/h5-7,9-10,16-19H,4,8,11-14H2,1-3H3/t16-,17+,18+/m1/s1
InChIKey GALLGXYNJMDOHQ-SQNIBIBYSA-N
Mol Weight 342.43 g/mol
Molecular Formula C18H30O6
Exact Mass 342.204239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID INdZkXkaVli
Name (2S,3S,4R)-1-(benzyloxy)-2,3-bis[(methoxymethyl)oxy]-4-heptanol
Alternate Name(s) 1-O-benzyl-5,6,7-trideoxy-2,3-bis-O-(methoxymethyl)-D-xylo-heptitol
CAS Registry Number 103499-49-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H30O6
InChI InChI=1S/C18H30O6/c1-4-8-16(19)18(24-14-21-3)17(23-13-20-2)12-22-11-15-9-6-5-7-10-15/h5-7,9-10,16-19H,4,8,11-14H2,1-3H3/t16-,17+,18+/m1/s1
InChIKey GALLGXYNJMDOHQ-SQNIBIBYSA-N
Molecular Weight 342.432 g/mol
SMILES O[C@@]([C@@]([C@@](OCOC)(COCc1ccccc1)[H])(OCOC)[H])(CCC)[H]
SPLASH splash10-0006-9100000000-5957bd1c3aa4e4f86ffb
Source of Spectrum J-51-3770-2
Wiley ID 1336462