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(1R,2S)-trans-2-Phenylcyclohexyl 2-Isopropoxyphenylacetate
SpectraBase Compound ID IyZ5foXR2Zu
InChI InChI=1S/C23H28O3/c1-17(2)25-22(19-13-7-4-8-14-19)23(24)26-21-16-10-9-15-20(21)18-11-5-3-6-12-18/h3-8,11-14,17,20-22H,9-10,15-16H2,1-2H3/t20-,21+,22?/m0/s1
InChIKey NOMTUVPPKSIAAA-UGGDCYSXSA-N
Mol Weight 352.47 g/mol
Molecular Formula C23H28O3
Exact Mass 352.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ONh1HaaJDb
Name (1R,2S)-trans-2-Phenylcyclohexyl 2-Isopropoxyphenylacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H28O3
InChI InChI=1S/C23H28O3/c1-17(2)25-22(19-13-7-4-8-14-19)23(24)26-21-16-10-9-15-20(21)18-11-5-3-6-12-18/h3-8,11-14,17,20-22H,9-10,15-16H2,1-2H3/t20-,21+,22?/m0/s1
InChIKey NOMTUVPPKSIAAA-UGGDCYSXSA-N
Molecular Weight 352.474 g/mol
SMILES C(O[C@]1([C@](c2ccccc2)(CCCC1)[H])[H])(C(OC(C)C)c1ccccc1)=O
SPLASH splash10-03di-0096000000-5f6cfe23014464cbd595
Source of Spectrum J-60-4458-8
Synonyms (1R,2S)-2-phenylcyclohexyl (2-isopropoxyphenyl)acetate Isopropoxy-phenyl-acetic acid (1R,2S)-2-phenyl-cyclohexyl ester
Wiley ID 1343657