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(2R,3E,3aR,6aR)-3-allylidene-2-methoxy-6a-methylol-3aH-cyclopenta[b]furan-4-one
SpectraBase Compound ID 5QnZb6klKe4
InChI InChI=1S/C12H14O4/c1-3-4-8-10-9(14)5-6-12(10,7-13)16-11(8)15-2/h3-6,10-11,13H,1,7H2,2H3/b8-4+/t10-,11+,12-/m0/s1
InChIKey ORQZYEGZQPYHQJ-JYWREFCWSA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID bV7C2zg3RW
Name (2R,3E,3aR,6aR)-3-allylidene-2-methoxy-6a-methylol-3aH-cyclopenta[b]furan-4-one
CAS Registry Number 116048-99-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-3-4-8-10-9(14)5-6-12(10,7-13)16-11(8)15-2/h3-6,10-11,13H,1,7H2,2H3/b8-4+/t10-,11+,12-/m0/s1
InChIKey ORQZYEGZQPYHQJ-JYWREFCWSA-N
Molecular Weight 222.240 g/mol
SMILES OC[C@]12[C@@](\C(=C/C=C)[C@@](O2)(OC)[H])(C(=O)C=C1)[H]
SPLASH splash10-0gxx-2900000000-711cd710da6fbe728832
Source of Spectrum C-112-3505-5
Synonyms (2R,3E,3aR,6aR)-3-allylidene-6a-(hydroxymethyl)-2-methoxy-3aH-cyclopenta[b]furan-4-one (2R,3E,3aR,6aR)-6a-(hydroxymethyl)-2-methoxy-3-prop-2-enylidene-3aH-cyclopenta[b]furan-4-one
Wiley ID 1222291