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N-[(2S,3R,4E)-1,3-Dihydroxy-15-methylhexadec-4-en-2-yl]tricosanamide
SpectraBase Compound ID Licbgh6TxZ3
InChI InChI=1S/C40H79NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-26-29-32-35-40(44)41-38(36-42)39(43)34-31-28-25-22-20-21-24-27-30-33-37(2)3/h31,34,37-39,42-43H,4-30,32-33,35-36H2,1-3H3,(H,41,44)/b34-31+/t38-,39+/m0/s1
InChIKey QXQXRHLOSBYVGT-DGTAADTBSA-N
Mol Weight 622.1 g/mol
Molecular Formula C40H79NO3
Exact Mass 621.605995 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JYQDAURvfkO
Name N-[(2S,3R,4E)-1,3-DIHYDROXY-15-METHYLHEXADEC-4-EN-2-YL]-TRICOSANAMIDE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H79NO3
InChI InChI=1S/C40H79NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-26-29-32-35-40(44)41-38(36-42)39(43)34-31-28-25-22-20-21-24-27-30-33-37(2)3/h31,34,37-39,42-43H,4-30,32-33,35-36H2,1-3H3,(H,41,44)/b34-31+/t38-,39+/m0/s1
InChIKey QXQXRHLOSBYVGT-DGTAADTBSA-N
Literature Reference Author I.MANCINI,G.GUELLA,C.DEBITUS,F.PIETRA
Literature Reference Citation HELV.CHIM.ACTA,77,51(1994)
Literature Reference DOI 10.1002/hlca.19940770108
Molecular Weight 622.072 g/mol
Solvent CDCl3
Source File Reference UWRK1951