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7-CHLORO-4-ETHOXYCARBONYL-METHYLENE-4,5-DIHYDROTETRAZOLO-[1,5-A]-QUINOXALINE,TAUTOMER-B
SpectraBase Compound ID 1xgyG8Ebtlp
InChI InChI=1S/C12H10ClN5O2/c1-2-20-11(19)6-9-12-15-16-17-18(12)10-4-3-7(13)5-8(10)14-9/h3-5H,2,6H2,1H3
InChIKey PFYZUKFUHGUUEW-UHFFFAOYSA-N
Mol Weight 291.7 g/mol
Molecular Formula C12H10ClN5O2
Exact Mass 291.052302 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KfyR6FkYPxU
Name 7-CHLORO-4-ETHOXYCARBONYL-METHYLENE-4,5-DIHYDROTETRAZOLO-[1,5-A]-QUINOXALINE,TAUTOMER-B
Compound Number 6A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H10ClN5O2
InChI InChI=1S/C12H10ClN5O2/c1-2-20-11(19)6-9-12-15-16-17-18(12)10-4-3-7(13)5-8(10)14-9/h3-5H,2,6H2,1H3
InChIKey PFYZUKFUHGUUEW-UHFFFAOYSA-N
Literature Reference Author Y.KURASAWA,T.KUREYAMA,N.YOSHISHIBA,T.OKANO,A.TAKADA,H.S.KIM, Y.OKAMOTO
Literature Reference Citation J.HETCYCL.CHEM.,30,781(1993)
Literature Reference DOI 10.1002/jhet.5570300329
Molecular Weight 291.697 g/mol
Solvent TFA-D1
Source File Reference UWPB308