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2-Ethyl-1-hydroxy-6-(4'-methoxyphenyl)-3-oxocyclohexanecarboxylic Acid
SpectraBase Compound ID 2HUiI9VGFh6
InChI InChI=1S/C16H20O5/c1-3-12-14(17)9-8-13(16(12,20)15(18)19)10-4-6-11(21-2)7-5-10/h4-7,12-13,20H,3,8-9H2,1-2H3,(H,18,19)
InChIKey ATMZZSBDJRBBCK-UHFFFAOYSA-N
Mol Weight 292.33 g/mol
Molecular Formula C16H20O5
Exact Mass 292.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KnyBnRjsh0T
Name 2-Ethyl-1-hydroxy-6-(4'-methoxyphenyl)-3-oxocyclohexanecarboxylic Acid
Alternate Name(s) 2-Ethyl-1-hydroxy-6-(4-methoxyphenyl)-3-oxocyclohexanecarboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O5
InChI InChI=1S/C16H20O5/c1-3-12-14(17)9-8-13(16(12,20)15(18)19)10-4-6-11(21-2)7-5-10/h4-7,12-13,20H,3,8-9H2,1-2H3,(H,18,19)
InChIKey ATMZZSBDJRBBCK-UHFFFAOYSA-N
Molecular Weight 292.331 g/mol
SMILES OC(C1(C(C(=O)CCC1c1ccc(cc1)OC)CC)O)=O
SPLASH splash10-001i-0900000000-d6136ece3e2c9c67f895
Source of Spectrum F-47-7962-17
Wiley ID 1295406