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1,3-Dioxolane-4-acetaldehyde, 2-(1,1-dimethylethyl)-4-methyl-5-oxo-, (2S-trans)-
SpectraBase Compound ID HqFvCYjYb5z
InChI InChI=1S/C10H16O4/c1-9(2,3)8-13-7(12)10(4,14-8)5-6-11/h6,8H,5H2,1-4H3/t8-,10-/m1/s1
InChIKey NRQWLHBWFUIWNL-PSASIEDQSA-N
Mol Weight 200.23 g/mol
Molecular Formula C10H16O4
Exact Mass 200.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HlEL7McxUDQ
Name 1,3-Dioxolane-4-acetaldehyde, 2-(1,1-dimethylethyl)-4-methyl-5-oxo-, (2S-trans)-
Alternate Name(s) (2S,5R)-2-(t-butyl)-5-methyl-4-oxo-1,3-dioxolan-5-yl acetaldehyde [(2S,4R)-2-tert-butyl-4-methyl-5-oxo-1,3-dioxolan-4-yl]acetaldehyde [(2S,5R)-2-(tert-butyl-5-methyl-4-oxo-1,3-dioxolan-5-yl]-acetaldehyde
CAS Registry Number 110561-92-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O4
InChI InChI=1S/C10H16O4/c1-9(2,3)8-13-7(12)10(4,14-8)5-6-11/h6,8H,5H2,1-4H3/t8-,10-/m1/s1
InChIKey NRQWLHBWFUIWNL-PSASIEDQSA-N
Molecular Weight 200.234 g/mol
SMILES [C@@]1(OC([C@](O1)(CC=O)C)=O)(C(C)(C)C)[H]
SPLASH splash10-0006-9200000000-0ccf819b3b9277588fda
Source of Spectrum F-42-6641-4
Wiley ID 1197438