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(2R,5S)-2-Isopropyl-3,6-dimethoxy-5-(2-methoxyethyl)-2,5-dihydropyrazine
SpectraBase Compound ID BI1VwzkiiVG
InChI InChI=1S/C12H22N2O3/c1-8(2)10-12(17-5)13-9(6-7-15-3)11(14-10)16-4/h8-10H,6-7H2,1-5H3/t9-,10+/m0/s1
InChIKey CEARINLGTASQOC-VHSXEESVSA-N
Mol Weight 242.32 g/mol
Molecular Formula C12H22N2O3
Exact Mass 242.163043 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FOjLA1tZQD7
Name (2R,5S)-2-Isopropyl-3,6-dimethoxy-5-(2-methoxyethyl)-2,5-dihydropyrazine
Comments Computed using HOSE algorithm
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Exact Mass 242.163042573 u
Formula C12H22N2O3
InChI InChI=1S/C12H22N2O3/c1-8(2)10-12(17-5)13-9(6-7-15-3)11(14-10)16-4/h8-10H,6-7H2,1-5H3/t9-,10+/m0/s1
InChIKey CEARINLGTASQOC-VHSXEESVSA-N
Molecular Weight 242.319 g/mol
SMILES C1(=N[C@@](C(=N[C@]1(CCOC)[H])OC)(C(C)C)[H])OC