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(2S)-2-[(1R,2R)-2-chloranyl-1-oxidanyl-cyclohexyl]pentanoic acid
SpectraBase Compound ID DPFLJT9Q8B4
InChI InChI=1S/C11H19ClO3/c1-2-5-8(10(13)14)11(15)7-4-3-6-9(11)12/h8-9,15H,2-7H2,1H3,(H,13,14)/t8-,9-,11-/m1/s1
InChIKey YURIEGLILNZXIQ-FXPVBKGRSA-N
Mol Weight 234.72 g/mol
Molecular Formula C11H19ClO3
Exact Mass 234.102272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7nmmP59dpaK
Name (2S)-2-[(1R,2R)-2-chloranyl-1-oxidanyl-cyclohexyl]pentanoic acid
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Formula C11H19ClO3
InChI InChI=1S/C11H19ClO3/c1-2-5-8(10(13)14)11(15)7-4-3-6-9(11)12/h8-9,15H,2-7H2,1H3,(H,13,14)/t8-,9-,11-/m1/s1
InChIKey YURIEGLILNZXIQ-FXPVBKGRSA-N
Molecular Weight 234.723 g/mol
SMILES O[C@]1([C@@](C(=O)O)(CCC)[H])[C@](Cl)(CCCC1)[H]
SPLASH splash10-001i-0910000000-d3e792dbbf5bb31ac659
Source of Spectrum SO-0-270-7
Synonyms (2S)-2-[(1R,2R)-2-chloro-1-hydroxy-cyclohexyl]pentanoic acid (2S)-2-[(1R,2R)-2-chloro-1-hydroxy-cyclohexyl]valeric acid
Wiley ID 865378