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4-[(2R,5S)-2-isopropyl-3,6-dimethoxy-5-propyl-2H-pyrazin-5-yl]butan-2-one
SpectraBase Compound ID 96SRkwgcAA1
InChI InChI=1S/C16H28N2O3/c1-7-9-16(10-8-12(4)19)15(21-6)17-13(11(2)3)14(18-16)20-5/h11,13H,7-10H2,1-6H3/t13-,16+/m1/s1
InChIKey NFDAJHPEQQYHRB-CJNGLKHVSA-N
Mol Weight 296.41 g/mol
Molecular Formula C16H28N2O3
Exact Mass 296.209993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K79yPWaLA20
Name 4-[(2R,5S)-2-isopropyl-3,6-dimethoxy-5-propyl-2H-pyrazin-5-yl]butan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28N2O3
InChI InChI=1S/C16H28N2O3/c1-7-9-16(10-8-12(4)19)15(21-6)17-13(11(2)3)14(18-16)20-5/h11,13H,7-10H2,1-6H3/t13-,16+/m1/s1
InChIKey NFDAJHPEQQYHRB-CJNGLKHVSA-N
Molecular Weight 296.411 g/mol
SMILES C1(=N[C@@](C(=N[C@]1(CCC(=O)C)CCC)OC)(C(C)C)[H])OC
SPLASH splash10-0gz9-0390000000-3378526422a3f02d429e
Source of Spectrum KD-15-1364-3
Synonyms 4-[(2R,5S)-3,6-dimethoxy-2-propan-2-yl-5-propyl-2H-pyrazin-5-yl]-2-butanone 4-[(2R,5S)-3,6-dimethoxy-2-propan-2-yl-5-propyl-2H-pyrazin-5-yl]butan-2-one
Wiley ID 1636943