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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 FSXt5AwTfy1
Name 7,8-Dihydrokavain
Carrier Gas Helium (1 ml/min)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 232.109944372 u
Formula C14H16O3
GC Column PTE-5 (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 275oC
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
Instrument Name Hewlett-Packard 5890 Series II GC-5971A MSD
Ionization Type EI
Literature Reference DOI 10.1002/jhrc.1240201007
Molecular Weight 232.279 g/mol
Quality 39
SMILES C1=CC=C(C=C1)CC[C@]1(CC(=CC(O1)=O)OC)[H]
SPLASH splash10-004l-4900000000-46399768caf8f0966d68
Source of Spectrum HRC-20-556-7,8-Dihydrokavain (DOI: 10.1002/jhrc.1240201007)
Wiley ID 1910877