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4-Octyne

View entire compound with spectra: 26 NMR, 5 FTIR, 2 Raman, 7 MS (GC), and 2 Near IR

4-Octyne
SpectraBase Compound ID CLtTcopsjTq
InChI InChI=1S/C8H14/c1-3-5-7-8-6-4-2/h3-6H2,1-2H3
InChIKey GZTNBKQTTZSQNS-UHFFFAOYSA-N
Mol Weight 110.2 g/mol
Molecular Formula C8H14
Exact Mass 110.10955 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Tib7N1IVo6
Name 4-OCTYNE
CAS Registry Number 1942-45-6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H14
InChI InChI=1S/C8H14/c1-3-5-7-8-6-4-2/h3-6H2,1-2H3
InChIKey GZTNBKQTTZSQNS-UHFFFAOYSA-N
Literature Reference Author D.E.DORMAN,M.JAUTELAT,J.D.ROBERTS
Literature Reference Citation J.ORG.CHEM.,38,1026(1973)
Literature Reference DOI 10.1021/jo00945a034
Molecular Weight 110.199 g/mol
Solvent Unknown
Source File Reference UWCS10296