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(S)-4-Ethyl-2-[1-butyl-5-(N-methyl-N-phenylsulfonylamino)pentyl]-4,5-dihydrooxazoline
SpectraBase Compound ID Iggco7IHrQK
InChI InChI=1S/C21H34N2O3S/c1-4-6-12-18(21-22-19(5-2)17-26-21)13-10-11-16-23(3)27(24,25)20-14-8-7-9-15-20/h7-9,14-15,18-19H,4-6,10-13,16-17H2,1-3H3/t18?,19-/m0/s1
InChIKey NFXSWNINXIEJHG-GGYWPGCISA-N
Mol Weight 394.6 g/mol
Molecular Formula C21H34N2O3S
Exact Mass 394.229014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8NMU11zx0d
Name (S)-4-Ethyl-2-[1-butyl-5-(N-methyl-N-phenylsulfonylamino)pentyl]-4,5-dihydrooxazoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34N2O3S
InChI InChI=1S/C21H34N2O3S/c1-4-6-12-18(21-22-19(5-2)17-26-21)13-10-11-16-23(3)27(24,25)20-14-8-7-9-15-20/h7-9,14-15,18-19H,4-6,10-13,16-17H2,1-3H3/t18?,19-/m0/s1
InChIKey NFXSWNINXIEJHG-GGYWPGCISA-N
Molecular Weight 394.574 g/mol
SMILES C(N(S(=O)(=O)c1ccccc1)C)CCCC(C1=N[C@@](CC)(CO1)[H])CCCC
SPLASH splash10-004l-9400000000-71e6bd0ce0f42a39ae59
Source of Spectrum SO-0-322-6
Synonyms N-{5-[(4S)-4-ethyl-4,5-dihydro-1,3-oxazol-2-yl]nonyl}-N-methylbenzenesulfonamide
Wiley ID 874337