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Cyclooctanone, 2-(2-hydroxy-2-phenylethyl)-, (R*,R*)-
SpectraBase Compound ID KNZUbFJtsGP
InChI InChI=1S/C16H22O2/c17-15-11-7-2-1-4-10-14(15)12-16(18)13-8-5-3-6-9-13/h3,5-6,8-9,14,16,18H,1-2,4,7,10-12H2/t14-,16-/m1/s1
InChIKey CLIJKOMBPZTXPK-GDBMZVCRSA-N
Mol Weight 246.35 g/mol
Molecular Formula C16H22O2
Exact Mass 246.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HQLz5ociIhT
Name Cyclooctanone, 2-(2-hydroxy-2-phenylethyl)-, (R*,R*)-
Alternate Name(s) (2R)-2-[(2R)-2-hydroxy-2-phenylethyl]cyclooctanone 2-(2-Hydroxy-2-phenyl)cyclooctanone
CAS Registry Number 114783-98-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O2
InChI InChI=1S/C16H22O2/c17-15-11-7-2-1-4-10-14(15)12-16(18)13-8-5-3-6-9-13/h3,5-6,8-9,14,16,18H,1-2,4,7,10-12H2/t14-,16-/m1/s1
InChIKey CLIJKOMBPZTXPK-GDBMZVCRSA-N
Molecular Weight 246.350 g/mol
SMILES O[C@](C[C@@]1(C(=O)CCCCCC1)[H])(c1ccccc1)[H]
SPLASH splash10-0002-9040000000-ccbc8402e7fece36c3ae
Source of Spectrum F-43-3383-31
Wiley ID 1249394