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7-Chloro-9-oxo-1,2,3,3a,4,9-hexahydropyrrolo[2,1-b]quinazoline-1-carboxylic acid

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7-Chloro-9-oxo-1,2,3,3a,4,9-hexahydropyrrolo[2,1-b]quinazoline-1-carboxylic acid
SpectraBase Compound ID s8FsbFOnlw
InChI InChI=1S/C12H11ClN2O3/c13-6-1-2-8-7(5-6)11(16)15-9(12(17)18)3-4-10(15)14-8/h1-2,5,9-10,14H,3-4H2,(H,17,18)/t9-,10+/m0/s1
InChIKey DUGCLFYHVLEZJQ-VHSXEESVSA-N
Mol Weight 266.68 g/mol
Molecular Formula C12H11ClN2O3
Exact Mass 266.04582 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DMz9uyqnNjn
Name 7-CHLORO-9-OXO-1,2,3,3A,4,9-HEXAHYDROPYRROLO-[2,1-B]-QUINAZOLINE-1-CARBOXYLIC-ACID
Compound Number 25
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H11ClN2O3
InChI InChI=1S/C12H11ClN2O3/c13-6-1-2-8-7(5-6)11(16)15-9(12(17)18)3-4-10(15)14-8/h1-2,5,9-10,14H,3-4H2,(H,17,18)/t9-,10+/m0/s1
InChIKey DUGCLFYHVLEZJQ-VHSXEESVSA-N
Literature Reference Author S.JOLIVET-FOUCHET,F.FABIS,P.BOVY,P.OCHSENBEIN,S.RAULT
Literature Reference Citation HETEROCYCLES,51,1257(1999)
Literature Reference DOI 10.3987/COM-98-8412
Molecular Weight 266.684 g/mol
Solvent DMSO-D6