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(2R,3S,4S)-3-(Hydroxymethyl)hexane-2,4-diol
SpectraBase Compound ID GMIDhNDFRX8
InChI InChI=1S/C7H16O3/c1-3-7(10)6(4-8)5(2)9/h5-10H,3-4H2,1-2H3/t5-,6+,7+/m1/s1
InChIKey PNGSZJCYHMHQGF-VQVTYTSYSA-N
Mol Weight 148.2 g/mol
Molecular Formula C7H16O3
Exact Mass 148.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ALHs3IrUPEF
Name (2R,3S,4S)-3-(Hydroxymethyl)hexane-2,4-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H16O3
InChI InChI=1S/C7H16O3/c1-3-7(10)6(4-8)5(2)9/h5-10H,3-4H2,1-2H3/t5-,6+,7+/m1/s1
InChIKey PNGSZJCYHMHQGF-VQVTYTSYSA-N
Molecular Weight 148.202 g/mol
SMILES O[C@@]([C@](CO)([C@@](O)(CC)[H])[H])(C)[H]
SPLASH splash10-0aor-9700000000-31ce8a9629f6b7ad00e4
Source of Spectrum H-76-472-14
Synonyms (2R,3S,4S)-3-(hydroxymethyl)-2,4-hexanediol
Wiley ID 1145376