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(4S)-2-heptadeca-5,8,11-trienyl-4-phenyl-4,5-dihydrooxazole

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(4S)-2-heptadeca-5,8,11-trienyl-4-phenyl-4,5-dihydrooxazole
SpectraBase Compound ID DVPTJ9ZMHYd
InChI InChI=1S/C26H37NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-26-27-25(23-28-26)24-20-17-16-18-21-24/h6-7,9-10,12-13,16-18,20-21,25H,2-5,8,11,14-15,19,22-23H2,1H3/t25-/m1/s1
InChIKey WEZMSLMMDGVTFK-RUZDIDTESA-N
Mol Weight 379.6 g/mol
Molecular Formula C26H37NO
Exact Mass 379.287515 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6CLMdnD06yl
Name (4S)-2-Heptadeca-5,8,11-trienyl-4-phenyl-4,5-dihydrooxazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 379.287514814 u
Formula C26H37NO
InChI InChI=1S/C26H37NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-26-27-25(23-28-26)24-20-17-16-18-21-24/h6-7,9-10,12-13,16-18,20-21,25H,2-5,8,11,14-15,19,22-23H2,1H3/t25-/m1/s1
InChIKey WEZMSLMMDGVTFK-RUZDIDTESA-N
Molecular Weight 379.588 g/mol
SMILES CCCCC\C=C\C\C=C\C\C=C\CCCCC1=N[C@](CO1)(C1=CC=CC=C1)[H]