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2-(2'-Chloro-1'-hydroxycyclohexyl)-2-methylpropanoic acid
SpectraBase Compound ID 97gCPRcXTQV
InChI InChI=1S/C10H17ClO3/c1-9(2,8(12)13)10(14)6-4-3-5-7(10)11/h7,14H,3-6H2,1-2H3,(H,12,13)
InChIKey FAWFBSJVZPOJFS-UHFFFAOYSA-N
Mol Weight 220.7 g/mol
Molecular Formula C10H17ClO3
Exact Mass 220.086622 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3kmCBkwwQUy
Name 2-(2'-Chloro-1'-hydroxycyclohexyl)-2-methylpropanoic acid
Alternate Name(s) (1'R*,2'R*)-2-(2'-Chloro-1'-hydroxycyclohexyl)-2-methylpropanoic acid 2-(2-Chloro-1-hydroxycyclohexyl)-2-methylpropanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H17ClO3
InChI InChI=1S/C10H17ClO3/c1-9(2,8(12)13)10(14)6-4-3-5-7(10)11/h7,14H,3-6H2,1-2H3,(H,12,13)
InChIKey FAWFBSJVZPOJFS-UHFFFAOYSA-N
Molecular Weight 220.696 g/mol
SMILES OC1(C(C(=O)O)(C)C)C(Cl)CCCC1
SPLASH splash10-00di-9030000000-b61bd40cafa8c5c4be31
Source of Spectrum SO-0-269-6
Wiley ID 865384