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Cyclopentaneacetic acid, 2-hydroxy-2-methyl-, methyl ester, trans-
SpectraBase Compound ID IUvtrzsnrBy
InChI InChI=1S/C9H16O3/c1-9(11)5-3-4-7(9)6-8(10)12-2/h7,11H,3-6H2,1-2H3/t7-,9-/m0/s1
InChIKey FIXUMOSVIWKIIY-CBAPKCEASA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID abTvZlQq2U
Name Cyclopentaneacetic acid, 2-hydroxy-2-methyl-, methyl ester, trans-
Alternate Name(s) Methyl[(1S,2S)-2-hydroxy-2-methylcyclopentyl]acetate
CAS Registry Number 96293-33-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-9(11)5-3-4-7(9)6-8(10)12-2/h7,11H,3-6H2,1-2H3/t7-,9-/m0/s1
InChIKey FIXUMOSVIWKIIY-CBAPKCEASA-N
Molecular Weight 172.224 g/mol
SMILES O[C@@]1([C@](CC(=O)OC)(CCC1)[H])C
SPLASH splash10-0aba-9400000000-a49cb3b169a280d84cdf
Source of Spectrum J-53-2294-9
Wiley ID 1168766