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Heptanal

View entire compound with spectra: 8 NMR, 12 FTIR, 1 Raman, 37 MS (GC), and 2 Near IR

Heptanal
SpectraBase Compound ID 9M2RcXVjtVD
InChI InChI=1S/C7H14O/c1-2-3-4-5-6-7-8/h7H,2-6H2,1H3
InChIKey FXHGMKSSBGDXIY-UHFFFAOYSA-N
Mol Weight 114.19 g/mol
Molecular Formula C7H14O
Exact Mass 114.104465 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4ChouPnzqJF
Name HEPTANALE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H14O
InChI InChI=1S/C7H14O/c1-2-3-4-5-6-7-8/h7H,2-6H2,1H3
InChIKey FXHGMKSSBGDXIY-UHFFFAOYSA-N
Literature Reference Author B.WRACKMEYER,K.VON-WERNER,F.WEHOWSKY
Literature Reference Citation J.FLUOR.CHEM.,35,359(1987)
Literature Reference DOI 10.1016/s0022-1139(00)85018-6
Molecular Weight 114.188 g/mol
Solvent CDCl3
Source File Reference UHPK2188