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(2S,3R,4S)-2,4-dimethylhexane-1,3-diol
SpectraBase Compound ID JezJ1sxSR7R
InChI InChI=1S/C8H18O2/c1-4-6(2)8(10)7(3)5-9/h6-10H,4-5H2,1-3H3/t6-,7-,8+/m0/s1
InChIKey LHFXJWUNNQVLMQ-BIIVOSGPSA-N
Mol Weight 146.23 g/mol
Molecular Formula C8H18O2
Exact Mass 146.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ha0AbMopmKt
Name (2S,3R,4S)-2,4-dimethylhexane-1,3-diol
CAS Registry Number 116348-88-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H18O2
InChI InChI=1S/C8H18O2/c1-4-6(2)8(10)7(3)5-9/h6-10H,4-5H2,1-3H3/t6-,7-,8+/m0/s1
InChIKey LHFXJWUNNQVLMQ-BIIVOSGPSA-N
Molecular Weight 146.230 g/mol
SMILES OC[C@@]([C@@]([C@](CC)(C)[H])(O)[H])(C)[H]
SPLASH splash10-05mo-9000000000-e12f5ba12722b5a73c0b
Source of Spectrum KC-1988-90-14
Wiley ID 1144244