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(S)-hept-6-yn-2-ol

View entire compound with spectra: 1 MS (GC)

(S)-hept-6-yn-2-ol
SpectraBase Compound ID ceXjXDiegl
InChI InChI=1S/C7H12O/c1-3-4-5-6-7(2)8/h1,7-8H,4-6H2,2H3/t7-/m0/s1
InChIKey UUVYQHRAOICJTA-ZETCQYMHSA-N
Mol Weight 112.17 g/mol
Molecular Formula C7H12O
Exact Mass 112.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CsyewqGfz7X
Name (S)-hept-6-yn-2-ol
Alternate Name(s) (2S)-6-heptyn-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O
InChI InChI=1S/C7H12O/c1-3-4-5-6-7(2)8/h1,7-8H,4-6H2,2H3/t7-/m0/s1
InChIKey UUVYQHRAOICJTA-ZETCQYMHSA-N
Literature Reference DOI 10.1021/ol800137f
Molecular Weight 112.172 g/mol
SMILES O[C@@](C)(CCCC#C)[H]
SPLASH splash10-00kb-9000000000-c47ce4cdfa0dc003c89c
Source of Spectrum A1-10-1533/SMS7-16
Wiley ID 1759266