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1-N-HEXYL-3-METHYL-4-NITROSO-5-PYRAZOLONE;OH-TAUTOMER

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1-N-HEXYL-3-METHYL-4-NITROSO-5-PYRAZOLONE;OH-TAUTOMER
SpectraBase Compound ID GDuR9qf49fp
InChI InChI=1S/2C10H17N3O2/c2*1-3-4-5-6-7-13-10(14)9(12-15)8(2)11-13/h2*14H,3-7H2,1-2H3
InChIKey QBNILIUSAILJSZ-UHFFFAOYSA-N
Mol Weight 422.53 g/mol
Molecular Formula C20H34N6O4
Exact Mass 422.264154 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5Cvh1D9kkPb
Name 1-N-HEXYL-3-METHYL-4-NITROSO-5-PYRAZOLONE;OH-TAUTOMER
Compound Number 2B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H34N6O4
InChI InChI=1S/2C10H17N3O2/c2*1-3-4-5-6-7-13-10(14)9(12-15)8(2)11-13/h2*14H,3-7H2,1-2H3
InChIKey QBNILIUSAILJSZ-UHFFFAOYSA-N
Literature Reference Author J.BARTULIN,J.BELMAR,H.GALLARDO,G.LEON
Literature Reference Citation J.HETCYCL.CHEM.,31,561(1994)
Literature Reference DOI 10.1002/jhet.5570310253
Solvent C6D6
Source File Reference UWCS18895