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1,16-DITHIOCARBAMYL-8-HYDROXYHEXADECANE
SpectraBase Compound ID 3x3d98nB9hG
InChI InChI=1S/C18H36N2O3S2/c19-17(22)24-14-10-6-2-1-4-8-12-16(21)13-9-5-3-7-11-15-25-18(20)23/h16,21H,1-15H2,(H2,19,22)(H2,20,23)
InChIKey ZPHVHMNXGWWZGV-UHFFFAOYSA-N
Mol Weight 392.6 g/mol
Molecular Formula C18H36N2O3S2
Exact Mass 392.216735 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 84uNsgrL9KT
Name 1,16-DITHIOCARBAMYL-8-HYDROXYHEXADECANE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H36N2O3S2
InChI InChI=1S/C18H36N2O3S2/c19-17(22)24-14-10-6-2-1-4-8-12-16(21)13-9-5-3-7-11-15-25-18(20)23/h16,21H,1-15H2,(H2,19,22)(H2,20,23)
InChIKey ZPHVHMNXGWWZGV-UHFFFAOYSA-N
Literature Reference Author R.J.CAPON,C.SKENE,E.H.T.LIU,E.LACEY,J.H.GILL,K.HEILAND,T.FRI EDEL
Literature Reference Citation J.NAT.PROD.,67,1277(2004)
Literature Reference DOI 10.1021/np049977y
Molecular Weight 392.615 g/mol
Solvent CD3OD
Source File Reference UWMZ6549