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1,3-Dioxane-4-acetaldehyde, 6-ethyl-.alpha.,2,2-trimethyl-, [4S-[4.alpha.(S*),6.beta.]]-
SpectraBase Compound ID 9rKpsY6Smre
InChI InChI=1S/C11H20O3/c1-5-9-6-10(8(2)7-12)14-11(3,4)13-9/h7-10H,5-6H2,1-4H3/t8?,9-,10+/m1/s1
InChIKey IRMINOHDFYXVLS-XVBQNVSMSA-N
Mol Weight 200.28 g/mol
Molecular Formula C11H20O3
Exact Mass 200.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GoZ7NtOIzxo
Name 1,3-Dioxane-4-acetaldehyde, 6-ethyl-.alpha.,2,2-trimethyl-, [4S-[4.alpha.(S*),6.beta.]]-
CAS Registry Number 129985-98-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O3
InChI InChI=1S/C11H20O3/c1-5-9-6-10(8(2)7-12)14-11(3,4)13-9/h7-10H,5-6H2,1-4H3/t8?,9-,10+/m1/s1
InChIKey IRMINOHDFYXVLS-XVBQNVSMSA-N
Molecular Weight 200.278 g/mol
SMILES C1(O[C@](C(C=O)C)(C[C@](O1)(CC)[H])[H])(C)C
SPLASH splash10-0a4i-9210000000-b9d935a0c0f565419cce
Source of Spectrum C-112-7018-20
Synonyms (5R)-2,4-dideoxy-5-C-ethyl-2-methyl-3,5-O-(1-methylethylidene)-L-glycero-pentose [2r,2(4R,6S)]-2-(2,2-dimethyl-4-ethyl-1,3-dioxan-6-yl)propanal [2s,2(4R,6S)]-2-(2,2-dimethyl-4-ethyl-1,3-dioxan-6-yl)propan-1-ol
Wiley ID 1197749