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3-Buten-2-one, 4-(tetrahydro-2,2-dimethylfuro[2,3-d]-1,3-dioxol-5-yl)-, [3aR-[3a.alpha.,5.alpha.(E),6a.alpha.]]-
SpectraBase Compound ID 94LZ3vmN5Uy
InChI InChI=1S/C11H16O4/c1-7(12)4-5-8-6-9-10(13-8)15-11(2,3)14-9/h4-5,8-10H,6H2,1-3H3/b5-4+/t8-,9-,10+/m0/s1
InChIKey WSIVZBFIRDFLIB-DOJWVHCASA-N
Mol Weight 212.24 g/mol
Molecular Formula C11H16O4
Exact Mass 212.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AHKwX2WcAE6
Name 3-Buten-2-one, 4-(tetrahydro-2,2-dimethylfuro[2,3-d]-1,3-dioxol-5-yl)-, [3aR-[3a.alpha.,5.alpha.(E),6a.alpha.]]-
CAS Registry Number 72704-89-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O4
InChI InChI=1S/C11H16O4/c1-7(12)4-5-8-6-9-10(13-8)15-11(2,3)14-9/h4-5,8-10H,6H2,1-3H3/b5-4+/t8-,9-,10+/m0/s1
InChIKey WSIVZBFIRDFLIB-DOJWVHCASA-N
Molecular Weight 212.245 g/mol
SMILES [C@@]12(OC(C)(C)O[C@]2(C[C@@](O1)(\C=C\C(=O)C)[H])[H])[H]
SPLASH splash10-052k-9300000000-123936676ac393f6c86b
Source of Spectrum H-62-2096-0
Synonyms (3E)-4-[(3aR,5R,6aS)-2,2-dimethyltetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-3-buten-2-one (E)-3,5,6,8-Tetradeoxy-1,2-O-isopropylidene-5-.alpha.-D-erythro-octeno-1,4-furannose-7-ulose Furo[2,3-d]-1,3-dioxole, 3-buten-2-one deriv.
Wiley ID 1211184