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Phosphonic acid, [4-methyl-2-[[(4-methylphenyl)sulfonyl]oxy]-3-oxo-1-pentenyl]-, bis(1-methylethyl) ester, (Z)-
SpectraBase Compound ID 3QAG3jUU4pS
InChI InChI=1S/C19H29O7PS/c1-13(2)19(20)18(12-27(21,24-14(3)4)25-15(5)6)26-28(22,23)17-10-8-16(7)9-11-17/h8-15H,1-7H3/b18-12-
InChIKey PNHBNVPVKNDFCT-PDGQHHTCSA-N
Mol Weight 432.47 g/mol
Molecular Formula C19H29O7PS
Exact Mass 432.137161 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DclmckPhOSv
Name Phosphonic acid, [4-methyl-2-[[(4-methylphenyl)sulfonyl]oxy]-3-oxo-1-pentenyl]-, bis(1-methylethyl) ester, (Z)-
CAS Registry Number 101133-00-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H29O7PS
InChI InChI=1S/C19H29O7PS/c1-13(2)19(20)18(12-27(21,24-14(3)4)25-15(5)6)26-28(22,23)17-10-8-16(7)9-11-17/h8-15H,1-7H3/b18-12-
InChIKey PNHBNVPVKNDFCT-PDGQHHTCSA-N
Molecular Weight 432.468 g/mol
SMILES C(OP(\C=C\(OS(c1ccc(cc1)C)(=O)=O)C(=O)C(C)C)(=O)OC(C)C)(C)C
SPLASH splash10-0a6r-0983000000-5ea5c2745ec49f872b28
Source of Spectrum K-118-4137-3
Synonyms (Z)-2-(diisopropoxyphosphoryl)-1-isobutyrylethenyl 4-methylbenzenesulfonate (Z)-[4-methyl-2-(4-methylphenylsalfonloxy)-3-oxo-1-pentenyl]phosphonsaure-diisopropylester
Wiley ID 1382132