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1,3-Cyclopentanedicarboxylic acid, 5-hydroxy-1,2,2-trimethyl-, 3-methyl ester, [1S-(1.alpha.,3.alpha.,5.alpha.)]-
SpectraBase Compound ID 7dDPErjWA2z
InChI InChI=1S/C11H18O5/c1-10(2)6(8(13)16-4)5-7(12)11(10,3)9(14)15/h6-7,12H,5H2,1-4H3,(H,14,15)/t6-,7-,11+/m1/s1
InChIKey FUWXTYZUJNKJTR-AMXGMDGSSA-N
Mol Weight 230.26 g/mol
Molecular Formula C11H18O5
Exact Mass 230.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1v5k1o6cbOv
Name 1,3-Cyclopentanedicarboxylic acid, 5-hydroxy-1,2,2-trimethyl-, 3-methyl ester, [1S-(1.alpha.,3.alpha.,5.alpha.)]-
CAS Registry Number 127255-24-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O5
InChI InChI=1S/C11H18O5/c1-10(2)6(8(13)16-4)5-7(12)11(10,3)9(14)15/h6-7,12H,5H2,1-4H3,(H,14,15)/t6-,7-,11+/m1/s1
InChIKey FUWXTYZUJNKJTR-AMXGMDGSSA-N
Molecular Weight 230.260 g/mol
SMILES O[C@@]1(C[C@@](C([C@@]1(C(=O)O)C)(C)C)(C(=O)OC)[H])[H]
SPLASH splash10-014i-0900000000-f794a94398d01338ebe6
Source of Spectrum J-55-4057-19
Synonyms (1S,2R,4S)-2-hydroxy-1,5,5-trimethyl-4-carbomethoxy-cyclopentanecarboxylic acid (1S,3S,5R)-5-hydroxy-3-(methoxycarbonyl)-1,2,2-trimethylcyclopentanecarboxylic acid
Wiley ID 1231469