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2-(1-Naphthylmethyl)hexanal
SpectraBase Compound ID 3RhwYtlE1sl
InChI InChI=1S/C17H20O/c1-2-3-7-14(13-18)12-16-10-6-9-15-8-4-5-11-17(15)16/h4-6,8-11,13-14H,2-3,7,12H2,1H3
InChIKey ZVWBHFPRXOZGOE-UHFFFAOYSA-N
Mol Weight 240.35 g/mol
Molecular Formula C17H20O
Exact Mass 240.151415 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JA4mVIrYoM1
Name 2-(1-Naphthylmethyl)hexanal
Comments Computed using HOSE algorithm
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Exact Mass 240.151415263 u
Formula C17H20O
InChI InChI=1S/C17H20O/c1-2-3-7-14(13-18)12-16-10-6-9-15-8-4-5-11-17(15)16/h4-6,8-11,13-14H,2-3,7,12H2,1H3
InChIKey ZVWBHFPRXOZGOE-UHFFFAOYSA-N
Molecular Weight 240.346 g/mol
SMILES C(C(CCCC)CC=1C=CC=C2C=CC=CC12)=O