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HYMENIACIDIN;MAJOR-ROTAMER
SpectraBase Compound ID 9ocm0xtbh92
InChI InChI=1S/C9H14N4O3/c1-10-7-6(11(2)5-14)8(15)13(4)9(16)12(7)3/h5,10H,1-4H3
InChIKey QASRNVMVWIIWKE-UHFFFAOYSA-N
Mol Weight 226.24 g/mol
Molecular Formula C9H14N4O3
Exact Mass 226.10659 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8nn7O4bvR2H
Name HYMENIACIDIN;MINOR-ROTAMER
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H14N4O3
InChI InChI=1S/C9H14N4O3/c1-10-7-6(11(2)5-14)8(15)13(4)9(16)12(7)3/h5,10H,1-4H3
InChIKey QASRNVMVWIIWKE-UHFFFAOYSA-N
Literature Reference Author R.J.CAPON,C.SKENE,D.VUONG,E.LACEY,J.H.GILL,K.HEILAND,T.FRIED EL
Literature Reference Citation J.NAT.PROD.,65,368(2002)
Literature Reference DOI 10.1021/np010337u
Molecular Weight 226.235 g/mol
Solvent CDCl3
Source File Reference UWSI4078