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3-Buten-2-one, 4-(6-chlorotetrahydro-2,2-dimethylfuro[2,3-d]-1,3-dioxol-5-yl)-, [3aR-[3a.alpha.,5.alpha.(E),6.alpha.,6a.alpha.]]-

View entire compound with spectra: 1 MS (GC)

3-Buten-2-one, 4-(6-chlorotetrahydro-2,2-dimethylfuro[2,3-d]-1,3-dioxol-5-yl)-, [3aR-[3a.alpha.,5.alpha.(E),6.alpha.,6a.alpha.]]-
SpectraBase Compound ID J1tJb6Ya1Wr
InChI InChI=1S/C11H15ClO4/c1-6(13)4-5-7-8(12)9-10(14-7)16-11(2,3)15-9/h4-5,7-10H,1-3H3/b5-4+/t7-,8+,9-,10-/m1/s1
InChIKey PHRQGYTWKJTCOE-DTYMUTQBSA-N
Mol Weight 246.69 g/mol
Molecular Formula C11H15ClO4
Exact Mass 246.065887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GRswP0lgETe
Name 3-Buten-2-one, 4-(6-chlorotetrahydro-2,2-dimethylfuro[2,3-d]-1,3-dioxol-5-yl)-, [3aR-[3a.alpha.,5.alpha.(E),6.alpha.,6a.alpha.]]-
CAS Registry Number 69984-03-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H15ClO4
InChI InChI=1S/C11H15ClO4/c1-6(13)4-5-7-8(12)9-10(14-7)16-11(2,3)15-9/h4-5,7-10H,1-3H3/b5-4+/t7-,8+,9-,10-/m1/s1
InChIKey PHRQGYTWKJTCOE-DTYMUTQBSA-N
Molecular Weight 246.690 g/mol
SMILES [C@@]12([C@@](OC(O2)(C)C)(O[C@@]([C@@]1(Cl)[H])(\C=C\C(=O)C)[H])[H])[H]
SPLASH splash10-052f-9110000000-f1552fb7c7d1f710c142
Source of Spectrum H-62-2097-0
Synonyms (3E)-4-[(3aR,5R,6S,6aS)-6-chloro-2,2-dimethyltetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-3-buten-2-one (E)-3-Chloro-3,5,6,8-tetradeoxy-1,2-O-isopropylidene-5-.alpha.-D-xylo-octeno-1,4-furannose-7-ulose Furo[2,3-d]-1,3-dioxole, 3-buten-2-one deriv.
Wiley ID 1248533