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UEQGBCSYJPCQNI-ZCFIWIBFSA-N

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UEQGBCSYJPCQNI-ZCFIWIBFSA-N
SpectraBase Compound ID 2e1KDzO8tHw
InChI InChI=1S/C8H11N3O2/c1-11-5-9-3-7(11)2-6-4-13-8(12)10-6/h3,5-6H,2,4H2,1H3,(H,10,12)/t6-/m1/s1
InChIKey UEQGBCSYJPCQNI-ZCFIWIBFSA-N
Mol Weight 181.19 g/mol
Molecular Formula C8H11N3O2
Exact Mass 181.085127 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E4jq9x9IKbw
Name UEQGBCSYJPCQNI-ZCFIWIBFSA-N
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H11N3O2
InChI InChI=1S/C8H11N3O2/c1-11-5-9-3-7(11)2-6-4-13-8(12)10-6/h3,5-6H,2,4H2,1H3,(H,10,12)/t6-/m1/s1
InChIKey UEQGBCSYJPCQNI-ZCFIWIBFSA-N
Literature Reference Author F.B.GONZALEZ,J.P.BAZ,M.I.R.ESPINA
Literature Reference Citation TETRAH.LETT.,30,2145(1989)
Literature Reference DOI 10.1016/S0040-4039(01)93734-7
Molecular Weight 181.194 g/mol
Solvent CD3OD
Source File Reference UWED11861