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(4R)-4-Ethynyl-4-(3-oxobutyl)-2,2-dimethyl-1,3-dioxolane
SpectraBase Compound ID 5ArtgPEFK6x
InChI InChI=1S/C11H16O3/c1-5-11(7-6-9(2)12)8-13-10(3,4)14-11/h1H,6-8H2,2-4H3/t11-/m1/s1
InChIKey PZNMRMXEBXPEFM-LLVKDONJSA-N
Mol Weight 196.25 g/mol
Molecular Formula C11H16O3
Exact Mass 196.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4GBOHEIvCA1
Name (4R)-4-Ethynyl-4-(3-oxobutyl)-2,2-dimethyl-1,3-dioxolane
Alternate Name(s) 4-[(4S)-4-ethynyl-2,2-dimethyl-1,3-dioxolan-4-yl]-2-butanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O3
InChI InChI=1S/C11H16O3/c1-5-11(7-6-9(2)12)8-13-10(3,4)14-11/h1H,6-8H2,2-4H3/t11-/m1/s1
InChIKey PZNMRMXEBXPEFM-LLVKDONJSA-N
Molecular Weight 196.246 g/mol
SMILES C1(O[C@](C#C)(CCC(=O)C)CO1)(C)C
SPLASH splash10-0006-9000000000-238d234c17284873d8ce
Source of Spectrum KC-0-295-9
Wiley ID 824272