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4-endo-Acetoxy-9-hydroxy-5-methylbicyclo[3.3.1]nonan-1-carboxylic Acid

View entire compound with spectra: 2 MS (GC)

4-endo-Acetoxy-9-hydroxy-5-methylbicyclo[3.3.1]nonan-1-carboxylic Acid
SpectraBase Compound ID DYczjBNTZ4I
InChI InChI=1S/C13H20O5/c1-8(14)18-9-4-7-13(11(16)17)6-3-5-12(9,2)10(13)15/h9-10,15H,3-7H2,1-2H3,(H,16,17)/t9?,10-,12+,13+/m0/s1
InChIKey FTWLDMPLXFRBIY-DUZFYQJISA-N
Mol Weight 256.3 g/mol
Molecular Formula C13H20O5
Exact Mass 256.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7FV0LHr7n7x
Name 4-endo-Acetoxy-9-hydroxy-5-methylbicyclo[3.3.1]nonan-1-carboxylic Acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O5
InChI InChI=1S/C13H20O5/c1-8(14)18-9-4-7-13(11(16)17)6-3-5-12(9,2)10(13)15/h9-10,15H,3-7H2,1-2H3,(H,16,17)/t9?,10-,12+,13+/m0/s1
InChIKey FTWLDMPLXFRBIY-DUZFYQJISA-N
Molecular Weight 256.298 g/mol
SMILES O[C@@]1([C@@]2(C(=O)O)CCC[C@]1(C)C(CC2)OC(=O)C)[H]
SPLASH splash10-029t-0920000000-c36910a678d5ec693186
Source of Spectrum F-47-9100-5
Synonyms 4-exo-Acetoxy-9-hydroxy-5-methylbicyclo[3.3.1]nonan-1-carboxylic Acid 4-(acetyloxy)-9-hydroxy-5-methylbicyclo[3.3.1]nonane-1-carboxylic acid
Wiley ID 1259575