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PYRENOCHAETIC-ACID-C;4-BUTYROYL-3-METHOXY-5-METHYLBENZOIC-ACID
SpectraBase Compound ID Dw4qv2eSsM3
InChI InChI=1S/C13H16O4/c1-4-5-10(14)12-8(2)6-9(13(15)16)7-11(12)17-3/h6-7H,4-5H2,1-3H3,(H,15,16)
InChIKey ZKCUSCDHGAMOSP-UHFFFAOYSA-N
Mol Weight 236.27 g/mol
Molecular Formula C13H16O4
Exact Mass 236.104859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3xFdJAYllwH
Name PYRENOCHAETIC-ACID-C;4-BUTYROYL-3-METHOXY-5-METHYLBENZOIC-ACID
Compound Number III
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-4-5-10(14)12-8(2)6-9(13(15)16)7-11(12)17-3/h6-7H,4-5H2,1-3H3,(H,15,16)
InChIKey ZKCUSCDHGAMOSP-UHFFFAOYSA-N
Literature Reference Author H.SATO,K.KONOMA,S.SAKAMURA
Literature Reference Citation AGR.BIOL.CHEM.,45,1675(1981)
Literature Reference DOI 10.1271/bbb1961.45.1675
Molecular Weight 236.268 g/mol
Solvent CDCl3
Source File Reference UWBT8420