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UKXSMDXYAOWHBT-UHFFFAOYSA-N

View entire compound with spectra: 3 NMR

UKXSMDXYAOWHBT-UHFFFAOYSA-N
SpectraBase Compound ID cYVhkykat2
InChI InChI=1S/C14H17ClF2N5O3PS/c1-3-24-26(23,25-4-2)14(16,17)13-21-9(6-27-13)5-22-8-20-10-11(15)18-7-19-12(10)22/h7-9H,3-6H2,1-2H3
InChIKey UKXSMDXYAOWHBT-UHFFFAOYSA-N
Mol Weight 439.81 g/mol
Molecular Formula C14H17ClF2N5O3PS
Exact Mass 439.044632 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LSGZ9pFydQ6
Name UKXSMDXYAOWHBT-UHFFFAOYSA-N
Compound Number 6
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H17ClF2N5O3PS
InChI InChI=1S/C14H17ClF2N5O3PS/c1-3-24-26(23,25-4-2)14(16,17)13-21-9(6-27-13)5-22-8-20-10-11(15)18-7-19-12(10)22/h7-9H,3-6H2,1-2H3
InChIKey UKXSMDXYAOWHBT-UHFFFAOYSA-N
Literature Reference Author E.PFUND,T.LEQUEUX,S.MASSON,M.VAZEUX
Literature Reference Citation ORG.LETTERS,4,843(2002)
Literature Reference DOI 10.1021/ol025544f
Molecular Weight 439.804 g/mol
Solvent CDCl3
Source File Reference UWMZ25378