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(2S)-2-(2-hydroxy-4-methylol-phenyl)-6-methyl-heptane-2,6-diol
SpectraBase Compound ID 5gyKymva7b4
InChI InChI=1S/C15H24O4/c1-14(2,18)7-4-8-15(3,19)12-6-5-11(10-16)9-13(12)17/h5-6,9,16-19H,4,7-8,10H2,1-3H3/t15-/m0/s1
InChIKey ZSQLKDGBAFLLSE-HNNXBMFYSA-N
Mol Weight 268.35 g/mol
Molecular Formula C15H24O4
Exact Mass 268.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LoOkUyWjGAZ
Name (2S)-2-(2-hydroxy-4-methylol-phenyl)-6-methyl-heptane-2,6-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O4
InChI InChI=1S/C15H24O4/c1-14(2,18)7-4-8-15(3,19)12-6-5-11(10-16)9-13(12)17/h5-6,9,16-19H,4,7-8,10H2,1-3H3/t15-/m0/s1
InChIKey ZSQLKDGBAFLLSE-HNNXBMFYSA-N
Molecular Weight 268.353 g/mol
SMILES OCc1cc(c([C@](CCCC(O)(C)C)(O)C)cc1)O
SPLASH splash10-014r-0950000000-55c998d2a551926fd5b2
Source of Spectrum ES-2005-338-1
Synonyms (2S)-2-[2-hydroxy-4-(hydroxymethyl)phenyl]-6-methyl-heptane-2,6-diol (2S)-2-[4-(hydroxymethyl)-2-oxidanyl-phenyl]-6-methyl-heptane-2,6-diol
Wiley ID 1563313