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(2R,5S)-2,5-Dihydro-3,6-dimethoxy-2-isopropyl-5-(4-pentenyl)-5-(2-propynyl)pyrazine

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(2R,5S)-2,5-Dihydro-3,6-dimethoxy-2-isopropyl-5-(4-pentenyl)-5-(2-propynyl)pyrazine
SpectraBase Compound ID 4ZBeCjs3IqK
InChI InChI=1S/C17H26N2O2/c1-7-9-10-12-17(11-8-2)16(21-6)18-14(13(3)4)15(19-17)20-5/h2,7,13-14H,1,9-12H2,3-6H3/t14-,17-/m1/s1
InChIKey NPMQBIOPDFJSOL-RHSMWYFYSA-N
Mol Weight 290.41 g/mol
Molecular Formula C17H26N2O2
Exact Mass 290.199428 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IQf2typImMZ
Name (2R,5S)-2,5-Dihydro-3,6-dimethoxy-2-isopropyl-5-(4-pentenyl)-5-(2-propynyl)pyrazine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 290.199428083 u
Formula C17H26N2O2
InChI InChI=1S/C17H26N2O2/c1-7-9-10-12-17(11-8-2)16(21-6)18-14(13(3)4)15(19-17)20-5/h2,7,13-14H,1,9-12H2,3-6H3/t14-,17-/m1/s1
InChIKey NPMQBIOPDFJSOL-RHSMWYFYSA-N
SMILES C1(=N[C@@](C(=N[C@]1(CC#C)CCCC=C)OC)(C(C)C)[H])OC