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ERIGERENONE-B
SpectraBase Compound ID 2WIuEifHxT0
InChI InChI=1S/C12H18O4/c1-4-5-8-9(6-12(14)16-3)10(13)7-11(8)15-2/h7-9H,4-6H2,1-3H3/t8-,9-/m1/s1
InChIKey NFRUZLCRXIYQPR-RKDXNWHRSA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JF5qx6mna0Z
Name ERIGERENONE-B
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-4-5-8-9(6-12(14)16-3)10(13)7-11(8)15-2/h7-9H,4-6H2,1-3H3/t8-,9-/m1/s1
InChIKey NFRUZLCRXIYQPR-RKDXNWHRSA-N
Literature Reference Author T.IIJIMA,Y.YAOITA,M.KIKUCHI
Literature Reference Citation CHEM.PHARM.BULL.,51,894(2003)
Literature Reference DOI 10.1248/cpb.51.894
Molecular Weight 226.273 g/mol
Solvent CDCl3
Source File Reference UWLU20202