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Cyclooctanone, 2-(2-hydroxy-2-phenylethyl)-, (R*,S*)-
SpectraBase Compound ID 8IrXwE01a5D
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
InChIKey CLIJKOMBPZTXPK-UHFFFAOYSA-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 HGeg3cbgn18
Name Cyclooctanone, 2-(2-hydroxy-2-phenylethyl)-, (R*,S*)-
CAS Registry Number 114783-99-2
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
InChIKey CLIJKOMBPZTXPK-UHFFFAOYSA-N
Molecular Weight 246.350 g/mol
SMILES OC(CC1C(=O)CCCCCC1)c1ccccc1
SPLASH splash10-002b-9520000000-5d2a786ddba2b5e3c217
Source of Spectrum F-43-3383-30
Synonyms 2-(2-Hydroxy-2-phenylethyl)cyclooctanone
Wiley ID 1249393