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HS071;METHYL-4-HYDROXYMETHYL-2-PENTYLFURAN-3-CARBOXYLATE
SpectraBase Compound ID LOcE6psUB4m
InChI InChI=1S/C12H18O4/c1-3-4-5-6-10-11(12(14)15-2)9(7-13)8-16-10/h8,13H,3-7H2,1-2H3
InChIKey BBRGDPBUQJUNSV-UHFFFAOYSA-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 C8xm4VvQ5QD
Name HS071;METHYL-4-HYDROXYMETHYL-2-PENTYLFURAN-3-CARBOXYLATE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-3-4-5-6-10-11(12(14)15-2)9(7-13)8-16-10/h8,13H,3-7H2,1-2H3
InChIKey BBRGDPBUQJUNSV-UHFFFAOYSA-N
Literature Reference Author J.WANG,H.ZHANG,X.YANG,Y.ZHOU,H.WANG,H.BAI
Literature Reference Citation J.ANTIBIOTICS,61,623(2008)
Literature Reference DOI 10.1038/ja.2008.82
Molecular Weight 226.273 g/mol
Solvent CDCl3
Source File Reference UWMB391