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2-[(1S,2R,4S)-4-hydroxy-2-(hydroxymethyl)cyclopentyl]acetic acid methyl ester
SpectraBase Compound ID 3kw0n3lGaZW
InChI InChI=1S/C9H16O4/c1-13-9(12)4-6-2-8(11)3-7(6)5-10/h6-8,10-11H,2-5H2,1H3/t6-,7-,8-/m0/s1
InChIKey VEYRSSUFYHLYII-FXQIFTODSA-N
Mol Weight 188.22 g/mol
Molecular Formula C9H16O4
Exact Mass 188.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6fy9IpsrJKR
Name 2-[(1S,2R,4S)-4-hydroxy-2-(hydroxymethyl)cyclopentyl]acetic acid methyl ester
Alternate Name(s) 2-[(1S,2R,4S)-4-hydroxy-2-methylol-cyclopentyl]acetic acid methyl ester Methyl 2-[(1S,2R,4S)-2-(hydroxymethyl)-4-oxidanyl-cyclopentyl]ethanoate Methyl 2-[(1S,2R,4S)-4-hydroxy-2-(hydroxymethyl)cyclopentyl]acetate
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Formula C9H16O4
InChI InChI=1S/C9H16O4/c1-13-9(12)4-6-2-8(11)3-7(6)5-10/h6-8,10-11H,2-5H2,1H3/t6-,7-,8-/m0/s1
InChIKey VEYRSSUFYHLYII-FXQIFTODSA-N
Molecular Weight 188.223 g/mol
SMILES O[C@]1(C[C@]([C@](CO)(C1)[H])(CC(=O)OC)[H])[H]
SPLASH splash10-00os-9100000000-3c67c25c92aafccbf571
Source of Spectrum H-76-254-12
Wiley ID 1184429