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(2S)-2-[(1R,2R)-2-chloranyl-1-oxidanyl-cyclopentyl]-2-phenyl-ethanoic acid
SpectraBase Compound ID AMTEbmTAq3K
InChI InChI=1S/C13H15ClO3/c14-10-7-4-8-13(10,17)11(12(15)16)9-5-2-1-3-6-9/h1-3,5-6,10-11,17H,4,7-8H2,(H,15,16)/t10-,11-,13+/m1/s1
InChIKey ZXZAZMQJYQWERD-WZRBSPASSA-N
Mol Weight 254.71 g/mol
Molecular Formula C13H15ClO3
Exact Mass 254.070972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kq96Qjf3APB
Name (2S)-2-[(1R,2R)-2-chloranyl-1-oxidanyl-cyclopentyl]-2-phenyl-ethanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15ClO3
InChI InChI=1S/C13H15ClO3/c14-10-7-4-8-13(10,17)11(12(15)16)9-5-2-1-3-6-9/h1-3,5-6,10-11,17H,4,7-8H2,(H,15,16)/t10-,11-,13+/m1/s1
InChIKey ZXZAZMQJYQWERD-WZRBSPASSA-N
Molecular Weight 254.713 g/mol
SMILES O[C@]1([C@@](C(=O)O)(c2ccccc2)[H])[C@](Cl)(CCC1)[H]
SPLASH splash10-00kf-9750000000-20d87f38932a3bebcce0
Source of Spectrum SO-0-271-8
Synonyms (2S)-2-[(1R,2R)-2-chloro-1-hydroxy-cyclopentyl]-2-phenyl-acetic acid
Wiley ID 865374