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Hexanoic acid, 3,5-dioxo-2-(triphenylphosphoranylidene)-, methyl ester
SpectraBase Compound ID 7phPKuLsIJg
InChI InChI=1S/C25H23O4P/c1-19(26)18-23(27)24(25(28)29-2)30(20-12-6-3-7-13-20,21-14-8-4-9-15-21)22-16-10-5-11-17-22/h3-17H,18H2,1-2H3
InChIKey QLWJSXCSZKAGJN-UHFFFAOYSA-N
Mol Weight 418.43 g/mol
Molecular Formula C25H23O4P
Exact Mass 418.133396 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4mUDliJQwtN
Name Hexanoic acid, 3,5-dioxo-2-(triphenylphosphoranylidene)-, methyl ester
CAS Registry Number 26535-32-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H23O4P
InChI InChI=1S/C25H23O4P/c1-19(26)18-23(27)24(25(28)29-2)30(20-12-6-3-7-13-20,21-14-8-4-9-15-21)22-16-10-5-11-17-22/h3-17H,18H2,1-2H3
InChIKey QLWJSXCSZKAGJN-UHFFFAOYSA-N
Molecular Weight 418.429 g/mol
SMILES CC(CC(C(C(=O)OC)=P(c1ccccc1)(c1ccccc1)c1ccccc1)=O)=O
SPLASH splash10-004i-0094100000-4b8cab47e1f83f6b63be
Source of Spectrum O-2-1020-1
Synonyms Methyl 3,5-dioxo-2-(triphenylphosphoranylidene)hexanoate 3,5-Diketo-2-triphenylphosphoranylidene-hexanoic acid methyl ester 3,5-Dioxo-2-triphenylphosphoranylidenehexanoic acid methyl ester Methyl 3,5-dioxo-2-(triphenyl-$l^{5}-phosphanylidene)hexanoate
Wiley ID 1377297