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2-(9-Octadecenoyl)-5-phenyloxazole

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2-(9-Octadecenoyl)-5-phenyloxazole
SpectraBase Compound ID 59BoqARLduK
InChI InChI=1S/C27H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-25(29)27-28-23-26(30-27)24-20-17-16-18-21-24/h9-10,16-18,20-21,23H,2-8,11-15,19,22H2,1H3/b10-9+
InChIKey JBJNKCWDUQMEEA-MDZDMXLPSA-N
Mol Weight 409.6 g/mol
Molecular Formula C27H39NO2
Exact Mass 409.298079 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LgmdZ7gY9LP
Name 2-(9-Octadecenoyl)-5-phenyloxazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 409.298079498 u
Formula C27H39NO2
InChI InChI=1S/C27H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-25(29)27-28-23-26(30-27)24-20-17-16-18-21-24/h9-10,16-18,20-21,23H,2-8,11-15,19,22H2,1H3/b10-9+
InChIKey JBJNKCWDUQMEEA-MDZDMXLPSA-N
Molecular Weight 409.614 g/mol
SMILES C1(=NC=C(O1)C1=CC=CC=C1)C(=O)CCCCCCC\C=C\CCCCCCCC