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(4-chlorophenyl)(6a,7,8,9-tetrahydropyrido[3,2-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl)methanone
SpectraBase Compound ID CswheDzHZFl
InChI InChI=1S/C17H16ClN3O/c18-13-7-5-12(6-8-13)17(22)21-11-14-3-2-10-20(14)16-15(21)4-1-9-19-16/h1,4-9,14H,2-3,10-11H2
InChIKey GTONJXDIGBBELW-UHFFFAOYSA-N
Mol Weight 313.79 g/mol
Molecular Formula C17H16ClN3O
Exact Mass 313.09819 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EGZgRKiyTgU
Name (4-chlorophenyl)(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 C17H16ClN3O
InChI InChI=1S/C17H16ClN3O/c18-13-7-5-12(6-8-13)17(22)21-11-14-3-2-10-20(14)16-15(21)4-1-9-19-16/h1,4-9,14H,2-3,10-11H2
InChIKey GTONJXDIGBBELW-UHFFFAOYSA-N
Instrument Name Shimadzu GC-MS-QP2010
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4270
Molecular Weight 313.788 g/mol
SMILES C(=O)(N1CC2N(c3c1cccn3)CCC2)c1ccc(cc1)Cl
SPLASH splash10-0229-2902000000-2ec4e4688e88c7c345ae
Source of Spectrum Y-58-SM23-2a
Wiley ID 1880941