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Diethyl (4-oxo-4-(2,6,6-trimethylcyclohex-1-en-1-yl)butan-2-yl)phosphonate
SpectraBase Compound ID Bmjqk2C8kRO
InChI InChI=1S/C17H31O4P/c1-7-20-22(19,21-8-2)14(4)12-15(18)16-13(3)10-9-11-17(16,5)6/h14H,7-12H2,1-6H3
InChIKey LDPCKJGIYHNPEX-UHFFFAOYSA-N
Mol Weight 330.4 g/mol
Molecular Formula C17H31O4P
Exact Mass 330.195996 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BfmRyfJeUHA
Name Diethyl (4-oxo-4-(2,6,6-trimethylcyclohex-1-en-1-yl)butan-2-yl)phosphonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H31O4P
InChI InChI=1S/C17H31O4P/c1-7-20-22(19,21-8-2)14(4)12-15(18)16-13(3)10-9-11-17(16,5)6/h14H,7-12H2,1-6H3
InChIKey LDPCKJGIYHNPEX-UHFFFAOYSA-N
Literature Reference DOI 10.1039/C6OB00242K
Molecular Weight 330.405 g/mol
SMILES C(P(OCC)(OCC)=O)(C)CC(=O)C=1C(CCCC1C)(C)C
SPLASH splash10-1030-3930000000-9072c8a9e08be507646c
Source of Spectrum F5-14-3521/SM8-3e
Wiley ID 1804705