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[(2-METHYLTHIOPHENYL)(PENT-4-ENOYL)-METHYLENE]-TRIPHENYL-PHOSPHORANE
SpectraBase Compound ID 4v9nuLejqZX
InChI InChI=1S/C31H29OPS/c1-3-4-23-29(32)31(28-22-14-15-24-30(28)34-2)33(25-16-8-5-9-17-25,26-18-10-6-11-19-26)27-20-12-7-13-21-27/h3,5-22,24H,1,4,23H2,2H3
InChIKey KYTYAQDDSLJUAM-UHFFFAOYSA-N
Mol Weight 480.61 g/mol
Molecular Formula C31H29OPS
Exact Mass 480.167674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4a2d0aYiDw
Name 1-(2-Methylsulfanyl-phenyl)-1-(triphenyl-lambda*5*-phosphanylidene)-hex-5-en-2-one
Alternate Name(s) 1-[2-(methylsulfanyl)phenyl]-1-(triphenylphosphoranylidene)-5-hexen-2-one [(2-Methylthiobenzoyl)(pent-4-enoyl)methylene]triphenylphosphorane
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Formula C31H29OPS
InChI InChI=1S/C31H29OPS/c1-3-4-23-29(32)31(28-22-14-15-24-30(28)34-2)33(25-16-8-5-9-17-25,26-18-10-6-11-19-26)27-20-12-7-13-21-27/h3,5-22,24H,1,4,23H2,2H3
InChIKey KYTYAQDDSLJUAM-UHFFFAOYSA-N
Molecular Weight 480.606 g/mol
SMILES C(=P(c1ccccc1)(c1ccccc1)c1ccccc1)(c1c(SC)cccc1)C(=O)CCC=C
SPLASH splash10-0059-0490600000-894bd5332cecb0e0718b
Source of Spectrum KC-0-3940-13
Wiley ID 827131