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NEOJUSTICIN-A

View entire compound with spectra: 1 NMR, and 1 MS (GC)

NEOJUSTICIN-A
SpectraBase Compound ID EXCpZH6p00T
InChI InChI=1S/C21H14O7/c1-23-20-12-6-17-16(27-9-28-17)5-11(12)18(13-7-24-21(22)19(13)20)10-2-3-14-15(4-10)26-8-25-14/h2-6H,7-9H2,1H3
InChIKey WOELDRZIQLRDQB-UHFFFAOYSA-N
Mol Weight 378.34 g/mol
Molecular Formula C21H14O7
Exact Mass 378.073953 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L1aUVXwG3wF
Name NEOJUSTICIN-A
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H14O7
InChI InChI=1S/C21H14O7/c1-23-20-12-6-17-16(27-9-28-17)5-11(12)18(13-7-24-21(22)19(13)20)10-2-3-14-15(4-10)26-8-25-14/h2-6H,7-9H2,1H3
InChIKey WOELDRZIQLRDQB-UHFFFAOYSA-N
Literature Reference Author M.YANG,J.WU,F.CHENG,Y.ZHOU
Literature Reference Citation MAGN.RES.CHEM.,44,727(2006)
Literature Reference DOI 10.1002/mrc.1830
Molecular Weight 378.338 g/mol
Sample ID 63609
Solvent DMSO-D6