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(2R,5S)-5-(3-Butenyl)-2,5-dihydro-3,6-dimethoxy-5-(4-hydroxy-2-butynyl)-2-isopropylpyrazine
SpectraBase Compound ID LkhRrThTPc4
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/h6,13-14,20H,1,7,10-12H2,2-5H3/t14-,17+/m1/s1
InChIKey DNOAJJZAKGCALR-PBHICJAKSA-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 DaZ3NKruahQ
Name (2R,5S)-5-(3-Butenyl)-2,5-dihydro-3,6-dimethoxy-5-(4-hydroxy-2-butynyl)-2-isopropylpyrazine
Alternate Name(s) (2S,5R)-5-(3-Butenyl)-2,5-dihydro-3,6-dimethoxy-5-(4-hydroxy-2-butynyl)-2-isopropylpyrazine 4-[(2S,5R)-2-(3-butenyl)-5-isopropyl-3,6-dimethoxy-2,5-dihydro-2-pyrazinyl]-2-butyn-1-ol 4-[(2R,5S)-5-but-3-enyl-3,6-dimethoxy-2-propan-2-yl-2H-pyrazin-5-yl]-2-butyn-1-ol 4-[(2R,5S)-5-but-3-enyl-3,6-dimethoxy-2-propan-2-yl-2H-pyrazin-5-yl]but-2-yn-1-ol
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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/h6,13-14,20H,1,7,10-12H2,2-5H3/t14-,17+/m1/s1
InChIKey DNOAJJZAKGCALR-PBHICJAKSA-N
Molecular Weight 306.406 g/mol
SMILES OCC#CC[C@]1(C(=N[C@@](C(=N1)OC)(C(C)C)[H])OC)CCC=C
SPLASH splash10-000b-0960000000-3ae5dbd34d595e2d0e8a
Source of Spectrum F-53-10610-7
Wiley ID 803116