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Pentanoic acid, 5-(dioctadecylamino)-5-oxo-
SpectraBase Compound ID IV08SX4BoCR
InChI InChI=1S/C41H81NO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38-42(40(43)36-35-37-41(44)45)39-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-39H2,1-2H3,(H,44,45)
InChIKey LGLSOGAEJSVXGD-UHFFFAOYSA-N
Mol Weight 636.1 g/mol
Molecular Formula C41H81NO3
Exact Mass 635.621645 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FOj5gQ3jNWu
Name Pentanoic acid, 5-(dioctadecylamino)-5-oxo-
CAS Registry Number 60387-08-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C41H81NO3
InChI InChI=1S/C41H81NO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38-42(40(43)36-35-37-41(44)45)39-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-39H2,1-2H3,(H,44,45)
InChIKey LGLSOGAEJSVXGD-UHFFFAOYSA-N
Molecular Weight 636.103 g/mol
SMILES OC(=O)CCCC(=O)N(CCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCC
SPLASH splash10-0f89-2090130000-2a8c2503a9fdf80b3079
Source of Spectrum H-65-61-0
Synonyms 5-(Dioctadecylamino)-5-oxopentanoic acid 5-(dioctadecylamino)-5-oxidanylidene-pentanoic acid 5-(distearylamino)-5-keto-valeric acid
Wiley ID 1412342