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Methyl 1(S)-hydroxycarbonyl-2(R),3(S)-[(dimethylmethylene)dioxy]-5(R)-hydroxy-4(R)-cyclopentanecarboxylate
SpectraBase Compound ID KuWp1lH1XW7
InChI InChI=1S/C11H16O7/c1-11(2)17-7-4(9(13)14)6(12)5(8(7)18-11)10(15)16-3/h4-8,12H,1-3H3,(H,13,14)/t4-,5+,6+,7+,8-/m0/s1
InChIKey MXBLWWSZXKZEJF-WCMLQCRESA-N
Mol Weight 260.24 g/mol
Molecular Formula C11H16O7
Exact Mass 260.089603 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ejQ0NJmGHV
Name Methyl 1(S)-hydroxycarbonyl-2(R),3(S)-[(dimethylmethylene)dioxy]-5(R)-hydroxy-4(R)-cyclopentanecarboxylate
CAS Registry Number 112653-35-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O7
InChI InChI=1S/C11H16O7/c1-11(2)17-7-4(9(13)14)6(12)5(8(7)18-11)10(15)16-3/h4-8,12H,1-3H3,(H,13,14)/t4-,5+,6+,7+,8-/m0/s1
InChIKey MXBLWWSZXKZEJF-WCMLQCRESA-N
Molecular Weight 260.242 g/mol
SMILES O[C@]1([C@]([C@]2([C@@]([C@]1(C(=O)O)[H])(OC(O2)(C)C)[H])[H])(C(=O)OC)[H])[H]
SPLASH splash10-0006-9210000000-853b8c0fc104f49834ef
Source of Spectrum J-53-941-8
Synonyms (3aR,4S,5R,6R,6aS)-5-hydroxy-6-(methoxycarbonyl)-2,2-dimethyltetrahydro-3aH-cyclopenta[d][1,3]dioxole-4-carboxylic acid
Wiley ID 1263239