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7-Bromo-4-hydroxy-4-methyl-3,4-dihydropyrrolo[1,2-a]pyrazin-1(2H)-one
SpectraBase Compound ID Klq1lXcelOD
InChI InChI=1S/C8H9BrN2O2/c1-8(13)4-10-7(12)6-2-5(9)3-11(6)8/h2-3,13H,4H2,1H3,(H,10,12)
InChIKey MWYJEFGVONXZKV-UHFFFAOYSA-N
Mol Weight 245.08 g/mol
Molecular Formula C8H9BrN2O2
Exact Mass 243.984741 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AHE6uN7t9XH
Name 7-Bromo-4-hydroxy-4-methyl-3,4-dihydropyrrolo[1,2-a]pyrazin-1(2H)-one
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 243.984740536 u
Formula C8H9BrN2O2
InChI InChI=1S/C8H9BrN2O2/c1-8(13)4-10-7(12)6-2-5(9)3-11(6)8/h2-3,13H,4H2,1H3,(H,10,12)
InChIKey MWYJEFGVONXZKV-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95 XLT
Ionization Type EI
Literature Reference DOI 10.1002/chem.201503695
Quality 61
Reported Formula C8H9BrN2O2
SMILES N1C(C=2N(C(C1)(C)O)C=C(C2)Br)=O
SPLASH splash10-00di-0960000000-61a75242888943923fbe
Source of Spectrum QE-22-SM32-52b (DOI: 10.1002/chem.201503695)
Thin-Layer Chromatography 0.40, 0.63 (CHCl3/MeOH, 10:1)
Wiley ID 1902975