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(1R,2S,3S)-4-(benzyloxy)-2,3-bis-[(methoxymethyl)oxy]-1-(p-methoxyphenyl)-1-butanol
SpectraBase Compound ID 3bVuySjFodN
InChI InChI=1S/C22H30O7/c1-24-15-28-20(14-27-13-17-7-5-4-6-8-17)22(29-16-25-2)21(23)18-9-11-19(26-3)12-10-18/h4-12,20-23H,13-16H2,1-3H3/t20-,21+,22+/m0/s1
InChIKey XHBIYWLTXGJGPH-BHDDXSALSA-N
Mol Weight 406.48 g/mol
Molecular Formula C22H30O7
Exact Mass 406.199153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4WfvmhMa9XW
Name (1R,2S,3S)-4-(benzyloxy)-2,3-bis-[(methoxymethyl)oxy]-1-(p-methoxyphenyl)-1-butanol
Alternate Name(s) (1R,2S,3S)-4-(benzyloxy)-2,3-bis(methoxymethoxy)-1-(4-methoxyphenyl)-1-butanol
CAS Registry Number 99878-64-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H30O7
InChI InChI=1S/C22H30O7/c1-24-15-28-20(14-27-13-17-7-5-4-6-8-17)22(29-16-25-2)21(23)18-9-11-19(26-3)12-10-18/h4-12,20-23H,13-16H2,1-3H3/t20-,21+,22+/m0/s1
InChIKey XHBIYWLTXGJGPH-BHDDXSALSA-N
Molecular Weight 406.475 g/mol
SMILES O[C@@]([C@@]([C@@](OCOC)(COCc1ccccc1)[H])(OCOC)[H])(c1ccc(cc1)OC)[H]
SPLASH splash10-06s6-3941000000-6ad5118b404187d02401
Source of Spectrum J-52-1959-4
Wiley ID 1372154