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4-Methyl-N-[(5R,6R)-5-(phenylmethoxymethyl)dodecan-6-yl]benzenesulfonamide
SpectraBase Compound ID FYg96mz0o92
InChI InChI=1S/C27H41NO3S/c1-4-6-8-12-16-27(28-32(29,30)26-19-17-23(3)18-20-26)25(15-7-5-2)22-31-21-24-13-10-9-11-14-24/h9-11,13-14,17-20,25,27-28H,4-8,12,15-16,21-22H2,1-3H3/t25-,27+/m0/s1
InChIKey FINLTDWXLLGZLN-AHKZPQOWSA-N
Mol Weight 459.7 g/mol
Molecular Formula C27H41NO3S
Exact Mass 459.280715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BR0plTbHcDZ
Name 4-Methyl-N-[(5R,6R)-5-(phenylmethoxymethyl)dodecan-6-yl]benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H41NO3S
InChI InChI=1S/C27H41NO3S/c1-4-6-8-12-16-27(28-32(29,30)26-19-17-23(3)18-20-26)25(15-7-5-2)22-31-21-24-13-10-9-11-14-24/h9-11,13-14,17-20,25,27-28H,4-8,12,15-16,21-22H2,1-3H3/t25-,27+/m0/s1
InChIKey FINLTDWXLLGZLN-AHKZPQOWSA-N
Molecular Weight 459.689 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)[C@@]([C@](COCc1ccccc1)(CCCC)[H])(CCCCCC)[H]
SPLASH splash10-014i-3191000000-f72e5ea937c4b52afbdd
Source of Spectrum K1-2004-4478-5
Synonyms N-[(1R)-1-[(1R)-1-(benzoxymethyl)pentyl]heptyl]-4-methyl-benzenesulfonamide
Wiley ID 1561844