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6-Heptyn-1-ol

View entire compound with spectra: 4 NMR, and 2 MS (GC)

6-Heptyn-1-ol
SpectraBase Compound ID 6aNyPD3PSBX
InChI InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h1,8H,3-7H2
InChIKey BVRCLEXKQNWTDK-UHFFFAOYSA-N
Mol Weight 112.17 g/mol
Molecular Formula C7H12O
Exact Mass 112.088815 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GzcKSJm9lih
Name 6-HEPTYN-1-OL
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H12O
InChI InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h1,8H,3-7H2
InChIKey BVRCLEXKQNWTDK-UHFFFAOYSA-N
Literature Reference Author S.PAIK,S.CARMELI,J.CULLINGHAM,R.E.MOORE,G.M.L.PATTERSON,M.A. TIUS
Literature Reference Citation J.AM.CHEM.SOC.,116,8116(1994)
Literature Reference DOI 10.1021/ja00097a019
Molecular Weight 112.172 g/mol
Solvent CDCl3