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(E)-3-octadecenal
SpectraBase Compound ID 5NuQvHi8Ohz
InChI InChI=1S/C18H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h15-16,18H,2-14,17H2,1H3/b16-15+
InChIKey SPEMIDIUIPMWBW-FOCLMDBBSA-N
Mol Weight 266.5 g/mol
Molecular Formula C18H34O
Exact Mass 266.260966 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7QV9tGJN9AA
Name (E)-3-Octadecenal
Comments Computed using HOSE algorithm
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Exact Mass 266.260965714 u
Formula C18H34O
InChI InChI=1S/C18H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h15-16,18H,2-14,17H2,1H3/b16-15+
InChIKey SPEMIDIUIPMWBW-FOCLMDBBSA-N
Molecular Weight 266.469 g/mol
SMILES C(\C=C\CC=O)CCCCCCCCCCCCC