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(2R,5S)-3,6-Diethoxy-2-isopropyl-5-(5-nitro-3-indolyl]methyl-2,5-dihydropyrazine
SpectraBase Compound ID HNtnAkNHlSs
InChI InChI=1S/C20H26N4O4/c1-5-27-19-17(22-20(28-6-2)18(23-19)12(3)4)9-13-11-21-16-8-7-14(24(25)26)10-15(13)16/h7-8,10-12,17-18,21H,5-6,9H2,1-4H3/t17-,18+/m0/s1
InChIKey WTFDJJKOAYYZJG-ZWKOTPCHSA-N
Mol Weight 386.45 g/mol
Molecular Formula C20H26N4O4
Exact Mass 386.195405 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3QySJWjljgB
Name (2R,5S)-3,6-Diethoxy-2-isopropyl-5-(5-nitro-3-indolyl]methyl-2,5-dihydropyrazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26N4O4
InChI InChI=1S/C20H26N4O4/c1-5-27-19-17(22-20(28-6-2)18(23-19)12(3)4)9-13-11-21-16-8-7-14(24(25)26)10-15(13)16/h7-8,10-12,17-18,21H,5-6,9H2,1-4H3/t17-,18+/m0/s1
InChIKey WTFDJJKOAYYZJG-ZWKOTPCHSA-N
Molecular Weight 386.452 g/mol
SMILES [nH]1c2ccc(cc2c(c1)C[C@]1(C(=N[C@@](C(=N1)OCC)(C(C)C)[H])OCC)[H])N(=O)=O
SPLASH splash10-014i-0931000000-ea32982e3026c8759a9c
Source of Spectrum J-66-4538-32
Synonyms 3-{[(2S,5R)-3,6-diethoxy-5-isopropyl-2,5-dihydro-2-pyrazinyl]methyl}-5-nitro-1H-indole 3-[[(2S,5R)-3,6-diethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-5-nitro-1H-indole
Wiley ID 1535416