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2H-Pyran-2-one, 5,6-dihydro-6-(3-oxo-1-butenyl)-, [R-(E)]-
SpectraBase Compound ID JFGAEmKaPQo
InChI InChI=1S/C9H10O3/c1-7(10)5-6-8-3-2-4-9(11)12-8/h2,4-6,8H,3H2,1H3/b6-5+/t8-/m1/s1
InChIKey VDZILYGLKXGVSS-HQZHTGGTSA-N
Mol Weight 166.18 g/mol
Molecular Formula C9H10O3
Exact Mass 166.062994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LV94TIzQVte
Name 2H-Pyran-2-one, 5,6-dihydro-6-(3-oxo-1-butenyl)-, [R-(E)]-
CAS Registry Number 94427-20-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10O3
InChI InChI=1S/C9H10O3/c1-7(10)5-6-8-3-2-4-9(11)12-8/h2,4-6,8H,3H2,1H3/b6-5+/t8-/m1/s1
InChIKey VDZILYGLKXGVSS-HQZHTGGTSA-N
Molecular Weight 166.176 g/mol
SMILES C1(O[C@@](\C=C\C(=O)C)(CC=C1)[H])=O
SPLASH splash10-014i-9800000000-9ce638fc4dfc5fdea143
Source of Spectrum J-50-466-14
Synonyms (6R)-6-[(1E)-3-oxo-1-butenyl]-5,6-dihydro-2H-pyran-2-one 1-O-2-(2-acetyl-ethenyl)-cyclohexan-4-en-6-one
Wiley ID 1162321