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(2S,5R)-2-(But-3-en-1-yl)-N-((1R,2R)-1-hydroxy-1-phenylpropan-2-yl)-N,5,9-trimethyldecanamide
SpectraBase Compound ID 9tQtQRgFFrW
InChI InChI=1S/C26H43NO2/c1-7-8-15-24(19-18-21(4)14-12-13-20(2)3)26(29)27(6)22(5)25(28)23-16-10-9-11-17-23/h7,9-11,16-17,20-22,24-25,28H,1,8,12-15,18-19H2,2-6H3/t21-,22-,24+,25+/m1/s1
InChIKey QYWDTZCIEPWLQA-SDZTWWDVSA-N
Mol Weight 401.6 g/mol
Molecular Formula C26H43NO2
Exact Mass 401.32938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9sxjnnLUVLI
Name (2S,5R)-2-(But-3-en-1-yl)-N-((1R,2R)-1-hydroxy-1-phenylpropan-2-yl)-N,5,9-trimethyldecanamide
Appearance Viscous colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H43NO2
InChI InChI=1S/C26H43NO2/c1-7-8-15-24(19-18-21(4)14-12-13-20(2)3)26(29)27(6)22(5)25(28)23-16-10-9-11-17-23/h7,9-11,16-17,20-22,24-25,28H,1,8,12-15,18-19H2,2-6H3/t21-,22-,24+,25+/m1/s1
InChIKey QYWDTZCIEPWLQA-SDZTWWDVSA-N
Instrument Name HP 6890-5973 or Agilent Technologies 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201900224
Molecular Weight 401.635 g/mol
SMILES O[C@](c1ccccc1)([C@@](C)(N(C(=O)[C@](CC[C@@](CCCC(C)C)(C)[H])(CCC=C)[H])C)[H])[H]
SPLASH splash10-0a4i-9010000000-f0c4f3ad8c554e2232ba
Source of Spectrum U1-2019-SM35-10a
Thin-Layer Chromatography Rf = 0.33 (silica gel, pentane/EtOAc, 3:1)
Wiley ID 1848584