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rel-(2S,4R,5R)-4-(2',3',4'-Trimethoxyphenyl)-2,5-dimethyl-1,3-dioxolane
SpectraBase Compound ID LkplCMF0S3L
InChI InChI=1S/C14H20O5/c1-8-12(19-9(2)18-8)10-6-7-11(15-3)14(17-5)13(10)16-4/h6-9,12H,1-5H3/t8-,9+,12+/m1/s1
InChIKey AFJAPDJMQFBWMD-PTRXPTGYSA-N
Mol Weight 268.31 g/mol
Molecular Formula C14H20O5
Exact Mass 268.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F86trgLDQmS
Name rel-(2S,4R,5R)-4-(2',3',4'-Trimethoxyphenyl)-2,5-dimethyl-1,3-dioxolane
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O5
InChI InChI=1S/C14H20O5/c1-8-12(19-9(2)18-8)10-6-7-11(15-3)14(17-5)13(10)16-4/h6-9,12H,1-5H3/t8-,9+,12+/m1/s1
InChIKey AFJAPDJMQFBWMD-PTRXPTGYSA-N
Instrument Name Finnigan-MAT GCQ
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0011.206
Molecular Weight 268.309 g/mol
SMILES c1(ccc(c(c1OC)OC)[C@]1(O[C@](O[C@@]1(C)[H])(C)[H])[H])OC
SPLASH splash10-00dl-0980000000-d405c244f4382f9f4bd0
Source of Spectrum ARK-2010-87-20e
Wiley ID 1866819