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9-Oxo-8-(4-phenyl-butyl)-1,4-dioxa-spiro[4.6]undecane-8-carboxylic acid ethyl ester
SpectraBase Compound ID 5sG1nHCzDA3
InChI InChI=1S/C22H30O5/c1-2-25-20(24)21(12-7-6-10-18-8-4-3-5-9-18)14-15-22(13-11-19(21)23)26-16-17-27-22/h3-5,8-9H,2,6-7,10-17H2,1H3
InChIKey HXZNGGDFZANSPY-UHFFFAOYSA-N
Mol Weight 374.48 g/mol
Molecular Formula C22H30O5
Exact Mass 374.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID i5uHzrriH5
Name 9-Oxo-8-(4-phenyl-butyl)-1,4-dioxa-spiro[4.6]undecane-8-carboxylic acid ethyl ester
Alternate Name(s) 9-(Ethoxycarbonyl)-9-(4-phenylbutyl)-1,4-dioxospiro[4.6]undecan-8-one Ethyl 9-oxo-8-(4-phenylbutyl)-1,4-dioxaspiro[4.6]undecane-8-carboxylate
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Formula C22H30O5
InChI InChI=1S/C22H30O5/c1-2-25-20(24)21(12-7-6-10-18-8-4-3-5-9-18)14-15-22(13-11-19(21)23)26-16-17-27-22/h3-5,8-9H,2,6-7,10-17H2,1H3
InChIKey HXZNGGDFZANSPY-UHFFFAOYSA-N
Molecular Weight 374.477 g/mol
SMILES C1(C(=O)OCC)(C(=O)CCC2(CC1)OCCO2)CCCCc1ccccc1
SPLASH splash10-0002-8329000000-154a6d33682e569a7549
Source of Spectrum KC-61-5078-23
Wiley ID 1629277