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Dihydrokavain
SpectraBase Compound ID Li3U62xlGgD
InChI InChI=1S/C14H16O3/c1-16-13-9-12(17-14(15)10-13)8-7-11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3/t12-/m0/s1
InChIKey VOOYTQRREPYRIW-LBPRGKRZSA-N
Mol Weight 232.28 g/mol
Molecular Formula C14H16O3
Exact Mass 232.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dk8QU3uTG08
Name Dihydrokavain
CAS Registry Number 587-63-3
Classification Kavalacton
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 232.109944372 u
Formula C14H16O3
InChI InChI=1S/C14H16O3/c1-16-13-9-12(17-14(15)10-13)8-7-11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3/t12-/m0/s1
InChIKey VOOYTQRREPYRIW-LBPRGKRZSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 232.279 g/mol
Nominal Mass 232 u
Quality 949
Retention Index 1710
SMILES [C@]1(CC(=CC(O1)=O)OC)(CCC1=CC=CC=C1)[H]
SPLASH splash10-00ou-8910000000-67783cfa675821c4bf2c
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms (6S)-4-methoxy-6-(2-phenylethyl)-5,6-dihydro-2H-pyran-2-one
Technique GC/MS
Wiley ID DD2024_033037