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(S)-3-Ethyl-3-hydroxyhexane-2,4-dione
SpectraBase Compound ID 5aVUpT2GIuO
InChI InChI=1S/C8H14O3/c1-4-7(10)8(11,5-2)6(3)9/h11H,4-5H2,1-3H3/t8-/m0/s1
InChIKey ARDHUNBGNCKXIZ-QMMMGPOBSA-N
Mol Weight 158.2 g/mol
Molecular Formula C8H14O3
Exact Mass 158.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2iqtBSKm9n7
Name (S)-3-Ethyl-3-hydroxyhexane-2,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O3
InChI InChI=1S/C8H14O3/c1-4-7(10)8(11,5-2)6(3)9/h11H,4-5H2,1-3H3/t8-/m0/s1
InChIKey ARDHUNBGNCKXIZ-QMMMGPOBSA-N
Literature Reference DOI 10.1002/anie.201408287
Molecular Weight 158.197 g/mol
SMILES O[C@](CC)(C(=O)CC)C(C)=O
SPLASH splash10-0zg0-8900000000-a39039a3d805249fe355
Source of Spectrum ACI-53-14402/SM-21
Synonyms 3-Ethyl-3-hydroxyhexane-2,4-dione
Wiley ID 1761057