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3-Bromomethyl-2-[(2R,5S)-2,5-dihydro-3,6-dimethoxy-2-isopropyl-5-pyrazinyl]-methylthiophene
SpectraBase Compound ID FtTZkXsEjJR
InChI InChI=1S/C15H21BrN2O2S/c1-9(2)13-15(20-4)17-11(14(18-13)19-3)7-12-10(8-16)5-6-21-12/h5-6,9,11,13H,7-8H2,1-4H3/t11-,13+/m0/s1
InChIKey RIYNRHNNBCWQHB-WCQYABFASA-N
Mol Weight 373.31 g/mol
Molecular Formula C15H21BrN2O2S
Exact Mass 372.050712 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DlPP3hkASWf
Name 3-Bromomethyl-2-[(2R,5S)-2,5-dihydro-3,6-dimethoxy-2-isopropyl-5-pyrazinyl]-methylthiophene
Alternate Name(s) (2S,5R)-2-{[3-(bromomethyl)-2-thienyl]methyl}-5-isopropyl-3,6-dimethoxy-2,5-dihydropyrazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H21BrN2O2S
InChI InChI=1S/C15H21BrN2O2S/c1-9(2)13-15(20-4)17-11(14(18-13)19-3)7-12-10(8-16)5-6-21-12/h5-6,9,11,13H,7-8H2,1-4H3/t11-,13+/m0/s1
InChIKey RIYNRHNNBCWQHB-WCQYABFASA-N
Molecular Weight 373.309 g/mol
SMILES C1(=N[C@@](C(=N[C@]1(Cc1c(ccs1)CBr)[H])OC)(C(C)C)[H])OC
SPLASH splash10-0006-0910000000-129c3fd11d5a958811c9
Source of Spectrum SB-51-398-14
Wiley ID 1355231