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Ethyl c-6-phenethyl-r-2,5,5-trimethyl-1,3-dixona-c-4-acetate
SpectraBase Compound ID 5O982kx33A9
InChI InChI=1S/C19H28O4/c1-5-21-18(20)13-17-19(3,4)16(22-14(2)23-17)12-11-15-9-7-6-8-10-15/h6-10,14,16-17H,5,11-13H2,1-4H3/t14-,16-,17?/m1/s1
InChIKey KBKWIODBUYPFSF-IYNBXCLQSA-N
Mol Weight 320.43 g/mol
Molecular Formula C19H28O4
Exact Mass 320.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LeGXV7jAJsf
Name Ethyl c-6-phenethyl-r-2,5,5-trimethyl-1,3-dixona-c-4-acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28O4
InChI InChI=1S/C19H28O4/c1-5-21-18(20)13-17-19(3,4)16(22-14(2)23-17)12-11-15-9-7-6-8-10-15/h6-10,14,16-17H,5,11-13H2,1-4H3/t14-,16-,17?/m1/s1
InChIKey KBKWIODBUYPFSF-IYNBXCLQSA-N
Molecular Weight 320.429 g/mol
SMILES C1(C([C@@](CCc2ccccc2)(O[C@](O1)(C)[H])[H])(C)C)CC(=O)OCC
SPLASH splash10-00kf-9100000000-bf26c4f8f8c68ad8b338
Source of Spectrum AJ-63-1912-31
Synonyms Ethyl[(2R,6R)-2,5,5-trimethyl-6-(2-phenylethyl)-1,3-dioxan-4-yl]acetate
Wiley ID 1320287