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1-(2,4,5-TRIMETHOXYPHENYL)-1,2-DIHYDROXYPROPANE
SpectraBase Compound ID 3vubStOhj6n
InChI InChI=1S/C12H18O5/c1-7(13)12(14)8-5-10(16-3)11(17-4)6-9(8)15-2/h5-7,12-14H,1-4H3
InChIKey ZSTCCLUBWBHJMP-UHFFFAOYSA-N
Mol Weight 242.27 g/mol
Molecular Formula C12H18O5
Exact Mass 242.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JVaAY0RGLpG
Name (1R,2R:1S,2S)-1-(2,4,5-trimethoxyphenyl)propan-1,2-diol
Classification Phenylpropanes
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 242.115423675 u
Formula C12H18O5
InChI InChI=1S/C12H18O5/c1-7(13)12(14)8-5-10(16-3)11(17-4)6-9(8)15-2/h5-7,12-14H,1-4H3
InChIKey ZSTCCLUBWBHJMP-UHFFFAOYSA-N
Molecular Weight 242.271 g/mol
Number of Peaks 16
SMILES OC(C(O)c1c(cc(c(c1)OC)OC)OC)C
SPLASH splash10-0002-1900000000-90d62bb9b281468930f0
Source of Spectrum FF-6-22-8A (DOI: 10.1002/ffj.2730060104)
Synonyms 1-(2,4,5-trimethoxyphenyl)propane-1,2-diol
Wiley ID 1801232