For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(2S,5S)-2-tert-butyl-5-[(1R)-1-methyl-3-oxo-pentyl]-5-phenyl-1,3-dioxolan-4-one
SpectraBase Compound ID 1mCOmNZYrbf
InChI InChI=1S/C19H26O4/c1-6-15(20)12-13(2)19(14-10-8-7-9-11-14)16(21)22-17(23-19)18(3,4)5/h7-11,13,17H,6,12H2,1-5H3/t13-,17-,19+/m1/s1
InChIKey ZYXVNHDLQCVYMZ-XVSDVWIESA-N
Mol Weight 318.41 g/mol
Molecular Formula C19H26O4
Exact Mass 318.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 88BHA0CPyD2
Name (2S,5S)-2-tert-butyl-5-[(1R)-1-methyl-3-oxo-pentyl]-5-phenyl-1,3-dioxolan-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O4
InChI InChI=1S/C19H26O4/c1-6-15(20)12-13(2)19(14-10-8-7-9-11-14)16(21)22-17(23-19)18(3,4)5/h7-11,13,17H,6,12H2,1-5H3/t13-,17-,19+/m1/s1
InChIKey ZYXVNHDLQCVYMZ-XVSDVWIESA-N
Molecular Weight 318.413 g/mol
SMILES C1([C@](O[C@@](O1)(C(C)(C)C)[H])([C@@](CC(=O)CC)(C)[H])c1ccccc1)=O
SPLASH splash10-0ab9-0951000000-e3169561017fc7ef692c
Source of Spectrum F-62-9177-4
Synonyms (2S,5S)-2-tert-butyl-5-[(1R)-3-keto-1-methyl-pentyl]-5-phenyl-1,3-dioxolan-4-one (2S,5S)-2-tert-butyl-5-[(2R)-4-oxidanylidenehexan-2-yl]-5-phenyl-1,3-dioxolan-4-one (2S,5S)-2-tert-butyl-5-[(2R)-4-oxohexan-2-yl]-5-phenyl-1,3-dioxolan-4-one
Wiley ID 1640734