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(1R*,3R*)-Acetic acid 3-bromo-1-cyclohexyl-3-phenylpropyl ester
SpectraBase Compound ID CgWnpqltAjy
InChI InChI=1S/C17H23BrO2/c1-13(19)20-17(15-10-6-3-7-11-15)12-16(18)14-8-4-2-5-9-14/h2,4-5,8-9,15-17H,3,6-7,10-12H2,1H3/t16-,17-/m1/s1
InChIKey QGIUYSINPSXEOT-IAGOWNOFSA-N
Mol Weight 339.27 g/mol
Molecular Formula C17H23BrO2
Exact Mass 338.088143 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9xyUcaXPUqJ
Name (1R*,3R*)-Acetic acid 3-bromo-1-cyclohexyl-3-phenylpropyl ester
Alternate Name(s) (1R,3R)-3-bromo-1-cyclohexyl-3-phenylpropyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23BrO2
InChI InChI=1S/C17H23BrO2/c1-13(19)20-17(15-10-6-3-7-11-15)12-16(18)14-8-4-2-5-9-14/h2,4-5,8-9,15-17H,3,6-7,10-12H2,1H3/t16-,17-/m1/s1
InChIKey QGIUYSINPSXEOT-IAGOWNOFSA-N
Molecular Weight 339.273 g/mol
SMILES C([C@@](OC(=O)C)(C1CCCCC1)[H])[C@](c1ccccc1)(Br)[H]
SPLASH splash10-014m-4900000000-5b0df1c47c2305bb18d2
Source of Spectrum KC-0-719-38
Wiley ID 830113