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2H-Pyran-2,5-diol, tetrahydro-6-methyl-, 5-acetate, [2S-(2.alpha.,5.alpha.,6.alpha.)]-
SpectraBase Compound ID 7msY6kl2jG1
InChI InChI=1S/C8H14O4/c1-5-7(12-6(2)9)3-4-8(10)11-5/h5,7-8,10H,3-4H2,1-2H3/t5-,7-,8-/m0/s1
InChIKey NNWBJOVUTCFRGH-GEVIPFJHSA-N
Mol Weight 174.2 g/mol
Molecular Formula C8H14O4
Exact Mass 174.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FpkcGePDq3r
Name 2H-Pyran-2,5-diol, tetrahydro-6-methyl-, 5-acetate, [2S-(2.alpha.,5.alpha.,6.alpha.)]-
CAS Registry Number 64447-83-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O4
InChI InChI=1S/C8H14O4/c1-5-7(12-6(2)9)3-4-8(10)11-5/h5,7-8,10H,3-4H2,1-2H3/t5-,7-,8-/m0/s1
InChIKey NNWBJOVUTCFRGH-GEVIPFJHSA-N
Molecular Weight 174.196 g/mol
SMILES O[C@]1(O[C@]([C@@](OC(=O)C)(CC1)[H])(C)[H])[H]
SPLASH splash10-000l-9100000000-02b353f31d8cb12adf41
Source of Spectrum K-110-2742-0
Synonyms (2S,3S,6S)-6-hydroxy-2-methyltetrahydro-2H-pyran-3-yl acetate Mixture of: 5-O-acetylchocinose and 4-O-acetylrhodinose
Wiley ID 1170318