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[2'-Isopropyl-5'-methylcyclohexyl] 2-chloro-2-fluoroacetate
SpectraBase Compound ID 2ZDXqDb8fCV
InChI InChI=1S/C12H20ClFO2/c1-7(2)9-5-4-8(3)6-10(9)16-12(15)11(13)14/h7-11H,4-6H2,1-3H3/t8-,9?,10-,11?/m1/s1
InChIKey RWRGZOKUNDBMBT-BZCXBAJXSA-N
Mol Weight 250.74 g/mol
Molecular Formula C12H20ClFO2
Exact Mass 250.113586 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Cjcw3Yj5s
Name [2'-Isopropyl-5'-methylcyclohexyl] 2-chloro-2-fluoroacetate
Alternate Name(s) 2-isopropyl-5-methylcyclohexyl chloro(fluoro)acetate Chloro-fluoro-acetic acid (R)-2-isopropyl-5-methyl-cyclohexyl ester
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Formula C12H20ClFO2
InChI InChI=1S/C12H20ClFO2/c1-7(2)9-5-4-8(3)6-10(9)16-12(15)11(13)14/h7-11H,4-6H2,1-3H3/t8-,9?,10-,11?/m1/s1
InChIKey RWRGZOKUNDBMBT-BZCXBAJXSA-N
Molecular Weight 250.741 g/mol
SMILES [C@@]1(OC(C(Cl)F)=O)(C(CC[C@](C1)(C)[H])C(C)C)[H]
SPLASH splash10-00l2-9300000000-345cb450ff5d51b2d5af
Source of Spectrum G-65-699-17
Wiley ID 871860