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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5qNoovWw78m
Name N-[(2S,3R,4E)-1,3-Dihydroxy-15-methylhexadec-4-en-2-yl]tricosanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. 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
Molecular Weight 622.076 g/mol
SMILES N([C@@](CO)([C@@](\C=C\CCCCCCCCCC(C)C)(O)[H])[H])C(=O)CCCCCCCCCCCCCCCCCCCCCC
SPLASH splash10-052f-9000000000-99013b45a919943d77b4
Source of Spectrum H-77-55-4
Synonyms N-[(E,2S,3R)-1,3-dihydroxy-15-methylhexadec-4-en-2-yl]tricosanamide N-[(E,1S,2R)-2-hydroxy-1-(hydroxymethyl)-14-methyl-pentadec-3-enyl]tricosanamide N-[(E,2S,3R)-15-methyl-1,3-bis(oxidanyl)hexadec-4-en-2-yl]tricosanamide
Wiley ID 1411608