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(3R,6S)-3-Acetoxy-6,7-isopropylidenedioxyhept-1-yne
SpectraBase Compound ID ANIyNMpWdMw
InChI InChI=1S/C12H18O4/c1-5-10(15-9(2)13)6-7-11-8-14-12(3,4)16-11/h1,10-11H,6-8H2,2-4H3/t10-,11-/m0/s1
InChIKey QUWGBTKBKRHRJG-QWRGUYRKSA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5l0RtyhWxKS
Name (3R,6S)-3-Acetoxy-6,7-isopropylidenedioxyhept-1-yne
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-5-10(15-9(2)13)6-7-11-8-14-12(3,4)16-11/h1,10-11H,6-8H2,2-4H3/t10-,11-/m0/s1
InChIKey QUWGBTKBKRHRJG-QWRGUYRKSA-N
Molecular Weight 226.272 g/mol
SMILES C1(O[C@@](CC[C@](C#C)(OC(=O)C)[H])(CO1)[H])(C)C
SPLASH splash10-0006-9110000000-62955df459a9991f3af8
Source of Spectrum KD-16-1121-39
Synonyms (1R)-1-{2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl}-2-propynyl acetate
Wiley ID 1637503