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1,3-Dihydro-4-methyl-2H-thieno[3,4-b][1,4]diazepin-2-one
SpectraBase Compound ID BnpSBSws7On
InChI InChI=1S/C8H8N2OS/c1-5-2-8(11)10-7-4-12-3-6(7)9-5/h3-4H,2H2,1H3,(H,10,11)
InChIKey AJZYFOIZVBZBEL-UHFFFAOYSA-N
Mol Weight 180.22 g/mol
Molecular Formula C8H8N2OS
Exact Mass 180.035734 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AzFXORfIhvJ
Name 1,3-DIHYDRO-4-METHYL-2H-THIENO-[3,4-B]-[1,4]-DIAZEPIN-2-ONE
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H8N2OS
InChI InChI=1S/C8H8N2OS/c1-5-2-8(11)10-7-4-12-3-6(7)9-5/h3-4H,2H2,1H3,(H,10,11)
InChIKey AJZYFOIZVBZBEL-UHFFFAOYSA-N
Literature Reference Author A.CHIMIRRI,R.GITTO,S.GRASSO,G.ROMEO,M.ZAPPALA
Literature Reference Citation HETEROCYCLES,34,1191(1992)
Literature Reference DOI 10.3987/COM-92-6016
Molecular Weight 180.224 g/mol
Solvent CDCl3
Source File Reference WANG1538