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(2R,4S,6R)-2-Tert-butyl-5-hydroxymethyl-6-methyl-4-(2'-phenyl-ethyl)1,3-dioxane
SpectraBase Compound ID GIBWhCiI0zG
InChI InChI=1S/C18H28O3/c1-13-15(12-19)16(21-17(20-13)18(2,3)4)11-10-14-8-6-5-7-9-14/h5-9,13,15-17,19H,10-12H2,1-4H3/t13-,15?,16+,17-/m1/s1
InChIKey DAJLTTYTOPQJGA-NHFRXMKASA-N
Mol Weight 292.42 g/mol
Molecular Formula C18H28O3
Exact Mass 292.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HRgnAObD0X5
Name (2R,4S,6R)-2-tert-Butyl-5-hydroxymethyl-6-methyl-4-(2'-phenyl-ethyl)1,3-dioxane
CAS Registry Number 129287-59-8
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H28O3
InChI InChI=1S/C18H28O3/c1-13-15(12-19)16(21-17(20-13)18(2,3)4)11-10-14-8-6-5-7-9-14/h5-9,13,15-17,19H,10-12H2,1-4H3/t13-,15?,16+,17-/m1/s1
InChIKey DAJLTTYTOPQJGA-NHFRXMKASA-N
Molecular Weight 292.419 g/mol
SMILES OCC1[C@](O[C@](O[C@]1(CCc1ccccc1)[H])(C(C)(C)C)[H])(C)[H]
SPLASH splash10-0006-9200000000-142cdefb5d0c818e8ff8
Source of Spectrum K-123-2422-23
Synonyms [(2R,4R,6S)-2-tert-butyl-4-methyl-6-(2-phenylethyl)-1,3-dioxan-5-yl]methanol
Wiley ID 1295740