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(1R,2S)-2-Allyl-1-[4-(benzyloxy)-3,5-dimethoxyphenyl]propane-1,3-diol
SpectraBase Compound ID 4CzigxWLr69
InChI InChI=1S/C21H26O5/c1-4-8-16(13-22)20(23)17-11-18(24-2)21(19(12-17)25-3)26-14-15-9-6-5-7-10-15/h4-7,9-12,16,20,22-23H,1,8,13-14H2,2-3H3/t16-,20+/m0/s1
InChIKey HZRWIOCALPGGAT-OXJNMPFZSA-N
Mol Weight 358.43 g/mol
Molecular Formula C21H26O5
Exact Mass 358.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J0FhDhgHhWp
Name (1R,2S)-2-Allyl-1-[4-(benzyloxy)-3,5-dimethoxyphenyl]propane-1,3-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26O5
InChI InChI=1S/C21H26O5/c1-4-8-16(13-22)20(23)17-11-18(24-2)21(19(12-17)25-3)26-14-15-9-6-5-7-10-15/h4-7,9-12,16,20,22-23H,1,8,13-14H2,2-3H3/t16-,20+/m0/s1
InChIKey HZRWIOCALPGGAT-OXJNMPFZSA-N
Molecular Weight 358.434 g/mol
SMILES OC[C@@]([C@](c1cc(c(c(c1)OC)OCc1ccccc1)OC)(O)[H])(CC=C)[H]
SPLASH splash10-0a4i-3965000000-947875f93fd93f15de89
Source of Spectrum F-70-7579-10
Synonyms (1R,2S)-2-allyl-1-(4-(benzyloxy)-3,5-dimethoxyphenyl)propane-1,3-diol
Wiley ID 1743156