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(4-nitrophenyl)(6a,7,8,9-tetrahydropyrido[3,2-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl)methanone
SpectraBase Compound ID BFYn0upSLfx
InChI InChI=1S/C17H16N4O3/c22-17(12-5-7-13(8-6-12)21(23)24)20-11-14-3-2-10-19(14)16-15(20)4-1-9-18-16/h1,4-9,14H,2-3,10-11H2
InChIKey QTGCERKLRANAEI-UHFFFAOYSA-N
Mol Weight 324.34 g/mol
Molecular Formula C17H16N4O3
Exact Mass 324.12224 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID NSDHg0LhKx
Name (4-nitrophenyl)(6a,7,8,9-tetrahydropyrido[3,2-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl)methanone
Appearance crystalline solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N4O3
InChI InChI=1S/C17H16N4O3/c22-17(12-5-7-13(8-6-12)21(23)24)20-11-14-3-2-10-19(14)16-15(20)4-1-9-18-16/h1,4-9,14H,2-3,10-11H2
InChIKey QTGCERKLRANAEI-UHFFFAOYSA-N
Instrument Name Shimadzu GC-MS-QP2010
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4270
Molecular Weight 324.340 g/mol
SMILES C(=O)(N1CC2N(c3c1cccn3)CCC2)c1ccc(cc1)[N+]([O-])=O
SPLASH splash10-00di-1903000000-7641d2bbdd7f22e27b91
Source of Spectrum Y-58-SM24-2c
Wiley ID 1880943