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(E,1S)-1-[(2R,5S)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]-2-hexadecen-1-ol
SpectraBase Compound ID 50tQ8en9Rlx
InChI InChI=1S/C25H46N2O3/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(28)23-25(30-5)26-22(20(2)3)24(27-23)29-4/h18-23,28H,6-17H2,1-5H3/b19-18+/t21-,22-,23+/m0/s1
InChIKey JSOHENFPAPDUHN-GBCOZUEXSA-N
Mol Weight 422.7 g/mol
Molecular Formula C25H46N2O3
Exact Mass 422.350843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HTnpofPzTCO
Name (E,1S)-1-[(2R,5S)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]-2-hexadecen-1-ol
Alternate Name(s) (E,1S)-1-[(2R,5S)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]hexadec-2-en-1-ol (E,1S)-1-[(2R,5S)-5-isopropyl-3,6-dimethoxy-2,5-dihydropyrazin-2-yl]hexadec-2-en-1-ol
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Formula C25H46N2O3
InChI InChI=1S/C25H46N2O3/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(28)23-25(30-5)26-22(20(2)3)24(27-23)29-4/h18-23,28H,6-17H2,1-5H3/b19-18+/t21-,22-,23+/m0/s1
InChIKey JSOHENFPAPDUHN-GBCOZUEXSA-N
Molecular Weight 422.654 g/mol
SMILES O[C@]([C@]1(N=C([C@@](N=C1OC)(C(C)C)[H])OC)[H])(\C=C\CCCCCCCCCCCCC)[H]
SPLASH splash10-0006-0900000000-7ff38bd43b53f9d9aeeb
Source of Spectrum F-47-2840-5
Wiley ID 1378723