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(2S,3S)-2-Methyloctane-1,3-diol
SpectraBase Compound ID 5ZaX7Y98Htr
InChI InChI=1S/C9H20O2/c1-3-4-5-6-9(11)8(2)7-10/h8-11H,3-7H2,1-2H3/t8-,9-/m0/s1
InChIKey WOOGQXANFLDMBB-IUCAKERBSA-N
Mol Weight 160.26 g/mol
Molecular Formula C9H20O2
Exact Mass 160.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGMAuHaqJQm
Name (2S,3S)-2-Methyloctane-1,3-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H20O2
InChI InChI=1S/C9H20O2/c1-3-4-5-6-9(11)8(2)7-10/h8-11H,3-7H2,1-2H3/t8-,9-/m0/s1
InChIKey WOOGQXANFLDMBB-IUCAKERBSA-N
Molecular Weight 160.257 g/mol
SMILES O[C@]([C@](CO)(C)[H])(CCCCC)[H]
SPLASH splash10-0159-9000000000-e0d2d3f309fbbc6a1ea3
Source of Spectrum J-67-3808-13
Wiley ID 1569971