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2-Ethyl 4-oxo-[1,3-b]-naphthodioxane
SpectraBase Compound ID R6BjTpn6Dc
InChI InChI=1S/C14H12O3/c1-2-13-16-12-8-10-6-4-3-5-9(10)7-11(12)14(15)17-13/h3-8,13H,2H2,1H3
InChIKey HZYTVJKNWQGMKK-UHFFFAOYSA-N
Mol Weight 228.25 g/mol
Molecular Formula C14H12O3
Exact Mass 228.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KCakPsduwyQ
Name 2-Ethyl 4-oxo-[1,3-b]-naphthodioxane
Appearance Colourless crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 228.078644243 u
Formula C14H12O3
InChI InChI=1S/C14H12O3/c1-2-13-16-12-8-10-6-4-3-5-9(10)7-11(12)14(15)17-13/h3-8,13H,2H2,1H3
InChIKey HZYTVJKNWQGMKK-UHFFFAOYSA-N
Instrument Name VG micromass 70/70F or a VG TRIO-1
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0002.810
Molecular Weight 228.247 g/mol
Quality 86
SMILES C1=CC2=C(C=C1)C=C1C(=C2)C(OC(O1)CC)=O
SPLASH splash10-022c-0900000000-87b7de15b58a409c131d
Source of Spectrum ARK-2001-100-5c (DOI: 10.3998/ark.5550190.0002.810)
Thin-Layer Chromatography 0.35
Wiley ID 1908896