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IXZWBWCCRQYVLB-RXMQYKEDSA-N
SpectraBase Compound ID 4gvofx7bamz
InChI InChI=1S/C8H12O3/c1-5-4-7(10-3)6(2)8(9)11-5/h5H,4H2,1-3H3/t5-/m1/s1
InChIKey IXZWBWCCRQYVLB-RXMQYKEDSA-N
Mol Weight 156.18 g/mol
Molecular Formula C8H12O3
Exact Mass 156.078644 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FH5UcqErAZw
Name IXZWBWCCRQYVLB-RXMQYKEDSA-N
Compound Number 7D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H12O3
InChI InChI=1S/C8H12O3/c1-5-4-7(10-3)6(2)8(9)11-5/h5H,4H2,1-3H3/t5-/m1/s1
InChIKey IXZWBWCCRQYVLB-RXMQYKEDSA-N
Literature Reference Author M.J.FEHR,G.CONSIGLIO,M.SCALONE,R.SCHMID
Literature Reference Citation J.ORG.CHEM.,64,5768(1999)
Literature Reference DOI 10.1021/jo982215l
Molecular Weight 156.181 g/mol
Sample ID 40175
Solvent CDCl3