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Phosphonic acid, (3,3,4-trimethyl-2-oxo-5-hexenyl)-, bis(1,1-dimethylethyl) ester, (.+-.)-
SpectraBase Compound ID 88U23lpzxP6
InChI InChI=1S/C17H33O4P/c1-11-13(2)17(9,10)14(18)12-22(19,20-15(3,4)5)21-16(6,7)8/h11,13H,1,12H2,2-10H3
InChIKey UBOCJJAFXGYWSH-UHFFFAOYSA-N
Mol Weight 332.4 g/mol
Molecular Formula C17H33O4P
Exact Mass 332.211647 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Crh18RcWS8c
Name Phosphonic acid, (3,3,4-trimethyl-2-oxo-5-hexenyl)-, bis(1,1-dimethylethyl) ester, (.+-.)-
CAS Registry Number 131617-18-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H33O4P
InChI InChI=1S/C17H33O4P/c1-11-13(2)17(9,10)14(18)12-22(19,20-15(3,4)5)21-16(6,7)8/h11,13H,1,12H2,2-10H3
InChIKey UBOCJJAFXGYWSH-UHFFFAOYSA-N
Molecular Weight 332.421 g/mol
SMILES C(P(OC(C)(C)C)(OC(C)(C)C)=O)C(C(C(C=C)C)(C)C)=O
SPLASH splash10-052b-9600000000-dfde6773b1d08e5cc8bf
Source of Spectrum J-56-1012-8
Synonyms di(tert-butyl) 3,3,4-trimethyl-2-oxo-5-hexenylphosphonate Di-t-butyl (3,3,4-trimethyl-2-oxo-5-hexenyl)-phosphonate
Wiley ID 1329291