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ETHYL-5-(3-METHYL-2-THIENYL)-3-OXO-2-TRIPHENYLPHOSPHORANYLIDENE-PENT-4-YNOATE
SpectraBase Compound ID 9vIa1r44fnS
InChI InChI=1S/C30H25O3PS/c1-3-33-30(32)29(27(31)19-20-28-23(2)21-22-35-28)34(24-13-7-4-8-14-24,25-15-9-5-10-16-25)26-17-11-6-12-18-26/h4-18,21-22H,3H2,1-2H3
InChIKey RYAUKPCQBKREST-UHFFFAOYSA-N
Mol Weight 496.56 g/mol
Molecular Formula C30H25O3PS
Exact Mass 496.126203 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3nmMO1EHdg
Name Ethyl 3-oxo-5-(3-methyl-2-thienyl)-2-triphenylphosphoranylidenepent-4-ynoate
Alternate Name(s) Ethyl 5-(3-methyl-2-thienyl)-3-oxo-2-(triphenylphosphoranylidene)-4-pentynoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H25O3PS
InChI InChI=1S/C30H25O3PS/c1-3-33-30(32)29(27(31)19-20-28-23(2)21-22-35-28)34(24-13-7-4-8-14-24,25-15-9-5-10-16-25)26-17-11-6-12-18-26/h4-18,21-22H,3H2,1-2H3
InChIKey RYAUKPCQBKREST-UHFFFAOYSA-N
Molecular Weight 496.561 g/mol
SMILES C(=P(c1ccccc1)(c1ccccc1)c1ccccc1)(C(=O)OCC)C(C#Cc1c(ccs1)C)=O
SPLASH splash10-001i-0932400000-a8d3dd827cf938eb7c9c
Source of Spectrum KC-0-2465-6
Wiley ID 782066