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2-(1-phenyl-5-pivaloyloxy-pentyl)malonic acid diethyl ester
SpectraBase Compound ID JfM7I7ihqKV
InChI InChI=1S/C23H34O6/c1-6-27-20(24)19(21(25)28-7-2)18(17-13-9-8-10-14-17)15-11-12-16-29-22(26)23(3,4)5/h8-10,13-14,18-19H,6-7,11-12,15-16H2,1-5H3
InChIKey KJFLCFUCBWNJIB-UHFFFAOYSA-N
Mol Weight 406.5 g/mol
Molecular Formula C23H34O6
Exact Mass 406.235539 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IVP1MQBB7HY
Name 2-(1-phenyl-5-pivaloyloxy-pentyl)malonic acid diethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H34O6
InChI InChI=1S/C23H34O6/c1-6-27-20(24)19(21(25)28-7-2)18(17-13-9-8-10-14-17)15-11-12-16-29-22(26)23(3,4)5/h8-10,13-14,18-19H,6-7,11-12,15-16H2,1-5H3
InChIKey KJFLCFUCBWNJIB-UHFFFAOYSA-N
Molecular Weight 406.519 g/mol
SMILES C(C(=O)OCC)(C(=O)OCC)C(c1ccccc1)CCCCOC(C(C)(C)C)=O
SPLASH splash10-052f-5900000000-6fae2830eca54aff455c
Source of Spectrum J-61-7479-7
Synonyms 2-[5-(2,2-dimethyl-1-oxopropoxy)-1-phenylpentyl]propanedioic acid diethyl ester Diethyl 2-[5-(2,2-dimethylpropanoyloxy)-1-phenyl-pentyl]propanedioate
Wiley ID 1372213