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1-[bis(2-hydroxyoctadecyl)amino]-2-octadecanol
SpectraBase Compound ID IDyHWiLroLI
InChI InChI=1S/C54H111NO3/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-52(56)49-55(50-53(57)47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2)51-54(58)48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3/h52-54,56-58H,4-51H2,1-3H3
InChIKey MYDKLTCCJRMUAY-UHFFFAOYSA-N
Mol Weight 822.5 g/mol
Molecular Formula C54H111NO3
Exact Mass 821.856396 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KXfM7AuDWwN
Name 1-[bis(2-hydroxyoctadecyl)amino]-2-octadecanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C54H111NO3
InChI InChI=1S/C54H111NO3/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-52(56)49-55(50-53(57)47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2)51-54(58)48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3/h52-54,56-58H,4-51H2,1-3H3
InChIKey MYDKLTCCJRMUAY-UHFFFAOYSA-N
Molecular Weight 822.486 g/mol
SMILES OC(CN(CC(CCCCCCCCCCCCCCCC)O)CC(O)CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC
SPLASH splash10-014i-7121090000-b560ad67ec593bc27586
Synonyms 1-[bis(2-hydroxyoctadecyl)amino]octadecan-2-ol 1-[bis(2-oxidanyloctadecyl)amino]octadecan-2-ol Tris(2-hydroxyoctadecyl)amine
Wiley ID 1479062