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(2R,5S)-5-(3-Butenyl)-2,5-dihydro-3,6-dimethoxy-5-E-(4-oxo-2-butenyl)-2-isopropylpyrazine
SpectraBase Compound ID C5mZVlK3nvR
InChI InChI=1S/C17H26N2O3/c1-6-7-10-17(11-8-9-12-20)16(22-5)18-14(13(2)3)15(19-17)21-4/h6,8-9,12-14H,1,7,10-11H2,2-5H3/b9-8+/t14-,17+/m1/s1
InChIKey OKHVUNOEOJCTGT-KPBXEYHCSA-N
Mol Weight 306.41 g/mol
Molecular Formula C17H26N2O3
Exact Mass 306.194343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8IisstGXdX4
Name (2R,5S)-5-(3-Butenyl)-2,5-dihydro-3,6-dimethoxy-5-E-(4-oxo-2-butenyl)-2-isopropylpyrazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26N2O3
InChI InChI=1S/C17H26N2O3/c1-6-7-10-17(11-8-9-12-20)16(22-5)18-14(13(2)3)15(19-17)21-4/h6,8-9,12-14H,1,7,10-11H2,2-5H3/b9-8+/t14-,17+/m1/s1
InChIKey OKHVUNOEOJCTGT-KPBXEYHCSA-N
Molecular Weight 306.406 g/mol
SMILES C1(=N[C@@](C(=N[C@]1(C\C=C\C=O)CCC=C)OC)(C(C)C)[H])OC
SPLASH splash10-0002-0970000000-43b04f1dc80d1e42a6a2
Source of Spectrum QC-9-2364-4
Synonyms (2E)-4-[(2S,5R)-2-(3-butenyl)-5-isopropyl-3,6-dimethoxy-2,5-dihydro-2-pyrazinyl]-2-butenal
Wiley ID 870694