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[(2S,7S)-7-hexyl-2-oxepanyl]methanol
SpectraBase Compound ID 4Psb7rCf7hu
InChI InChI=1S/C13H26O2/c1-2-3-4-5-8-12-9-6-7-10-13(11-14)15-12/h12-14H,2-11H2,1H3/t12-,13-/m0/s1
InChIKey APUGJDUDUBXCJG-STQMWFEESA-N
Mol Weight 214.35 g/mol
Molecular Formula C13H26O2
Exact Mass 214.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2vBcxY2mp68
Name [(2S,7S)-7-hexyl-2-oxepanyl]methanol
CAS Registry Number 123151-65-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H26O2
InChI InChI=1S/C13H26O2/c1-2-3-4-5-8-12-9-6-7-10-13(11-14)15-12/h12-14H,2-11H2,1H3/t12-,13-/m0/s1
InChIKey APUGJDUDUBXCJG-STQMWFEESA-N
Molecular Weight 214.349 g/mol
SMILES OC[C@]1(O[C@@](CCCCCC)(CCCC1)[H])[H]
SPLASH splash10-05o1-9800000000-d3c4cb2aa2829560766a
Source of Spectrum J-54-5158-15
Synonyms [(2S,7S)-7-hexyloxepan-2-yl]methanol
Wiley ID 1213902