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3-Hydroxy-2-(methoxycarbonyl)-5-propyl-9-oxabicyclo[3.3.1]non-2-ene
SpectraBase Compound ID 64STx6wbwg7
InChI InChI=1S/C13H20O4/c1-3-6-13-7-4-5-10(17-13)11(9(14)8-13)12(15)16-2/h10-11H,3-8H2,1-2H3
InChIKey ZTQDTLHIJHIUTP-UHFFFAOYSA-N
Mol Weight 240.3 g/mol
Molecular Formula C13H20O4
Exact Mass 240.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BuPgoCiYm05
Name 3-Hydroxy-2-(methoxycarbonyl)-5-propyl-9-oxabicyclo[3.3.1]non-2-ene
Alternate Name(s) 3-Oxo-2-(methoxycarbonyl)-5-propyl-9-oxabicyclo[3.3.1]nonane Methyl 3-hydroxy-5-propyl-9-oxabicyclo[3.3.1]non-2-ene-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O4
InChI InChI=1S/C13H20O4/c1-3-6-13-7-4-5-10(17-13)11(9(14)8-13)12(15)16-2/h10-11H,3-8H2,1-2H3
InChIKey ZTQDTLHIJHIUTP-UHFFFAOYSA-N
Molecular Weight 240.299 g/mol
SMILES C1(C(CC2(OC1CCC2)CCC)=O)C(=O)OC
SPLASH splash10-0002-2900000000-b49e33e6b114e7abed24
Source of Spectrum C-115-845-7
Wiley ID 1242889