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3-Bromo-1,2,3,4,7,8,9,10-octahydro-11H,13H-benzo[4',5']thieno[3',2':4,5]pyrimidino[1,2-a]azepine-4,13-dione
SpectraBase Compound ID Hj67xIM2Jr7
InChI InChI=1S/C15H15BrN2O2S/c16-9-6-5-8-11-14(21-13(8)12(9)19)17-10-4-2-1-3-7-18(10)15(11)20/h9H,1-7H2
InChIKey IVCYKDGSQAGJHW-UHFFFAOYSA-N
Mol Weight 367.26 g/mol
Molecular Formula C15H15BrN2O2S
Exact Mass 366.003762 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FAkNDnJQ2zM
Name 3-BROMO-1,2,3,4,7,8,9,10-OCTAHYDRO-11H,13H-BENZO[4',5']THIENO[3',2':4,
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H15BrN2O2S
InChI InChI=1S/C15H15BrN2O2S/c16-9-6-5-8-11-14(21-13(8)12(9)19)17-10-4-2-1-3-7-18(10)15(11)20/h9H,1-7H2
InChIKey IVCYKDGSQAGJHW-UHFFFAOYSA-N
Molecular Weight 366.0034
SMILES C1(Br)C(=O)c2sc3N=C4CCCCCN4C(=O)c3c2CC1
SPLASH splash10-052o-9210000000-1ceb3b27c5ae5047fe79
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany