SpectraBase Compound ID | 1Em6uqtWhq2 |
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InChI | InChI=1S/2C20H22O3.H2O/c2*1-22-19-11-9-16(13-20(19)23-2)15-8-10-17(18(21)12-15)14-6-4-3-5-7-14;/h2*3-7,9,11,13,15,17H,8,10,12H2,1-2H3;1H2 |
InChIKey | ZERDYFBXRVKBCI-UHFFFAOYSA-N |
Mol Weight | 319.401 g/mol |
Molecular Formula | C20H22O3·½H2O |
Exact Mass | 319.162177 g/mol |
SpectraBase Spectrum ID | FnHwxUnCkXA |
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Name | 5-(3,4-dimethoxyphenyl)-2-phenylcyclohexanone, hemihydrate |
Conditions | Neutral |
Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C20H24O4 |
InChI | InChI=1S/2C20H22O3.H2O/c2*1-22-19-11-9-16(13-20(19)23-2)15-8-10-17(18(21)12-15)14-6-4-3-5-7-14;/h2*3-7,9,11,13,15,17H,8,10,12H2,1-2H3;1H2 |
InChIKey | ZERDYFBXRVKBCI-UHFFFAOYSA-N |
Sadtler IR Number | 17276 |
Sadtler UV Number | 7299N |
Solvent | Methanol |