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ALPHA-5-C-(3-HYDROXYBUTYL)-HYACINTHACINE_A_2
SpectraBase Compound ID 1Pqd5UmTXyx
InChI InChI=1S/C12H23NO4/c1-7(15)2-3-8-4-5-9-11(16)12(17)10(6-14)13(8)9/h7-12,14-17H,2-6H2,1H3/t7?,8-,9-,10-,11-,12-/m1/s1
InChIKey CGZUVSCEWJVPBT-LVZGIILASA-N
Mol Weight 245.32 g/mol
Molecular Formula C12H23NO4
Exact Mass 245.162708 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6mWxOMm4EyU
Name ALPHA-5-C-(3-HYDROXYBUTYL)-HYACINTHACINE_A_2
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H23NO4
InChI InChI=1S/C12H23NO4/c1-7(15)2-3-8-4-5-9-11(16)12(17)10(6-14)13(8)9/h7-12,14-17H,2-6H2,1H3/t7?,8-,9-,10-,11-,12-/m1/s1
InChIKey CGZUVSCEWJVPBT-LVZGIILASA-N
Literature Reference Author A.KATO,N.KATO,I.ADACHI,J.HOLLINSHEAD,G.W.J.FLEET,C.KURIYAMA, K.IKEDA,N.ASANO,R.J.
Literature Reference Citation J.NAT.PROD.,70,993(2007)
Literature Reference DOI 10.1021/np0700826
Molecular Weight 245.319 g/mol
Sample ID 30516
Solvent D2O