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[5-Butyl-3-(4-methylphenyl)-4-hexynylbenzyl]diphenylphosphine oxide
SpectraBase Compound ID Gtj7ffEbFoX
InChI InChI=1S/C36H39OP/c1-4-6-15-30-16-13-17-33(28-30)36(27-26-31(14-5-2)32-24-22-29(3)23-25-32)38(37,34-18-9-7-10-19-34)35-20-11-8-12-21-35/h7-13,16-25,28,31,36H,4,6,15,26-27H2,1-3H3
InChIKey CJTZMCUERJDKAB-UHFFFAOYSA-N
Mol Weight 518.7 g/mol
Molecular Formula C36H39OP
Exact Mass 518.273853 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LN5hX7gHjeg
Name [5-Butyl-3-(4-methylphenyl)-4-hexynylbenzyl]diphenylphosphine oxide
Alternate Name(s) [1-(3-butylphenyl)-4-(4-methylphenyl)-5-heptynyl](diphenyl)phosphine oxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H39OP
InChI InChI=1S/C36H39OP/c1-4-6-15-30-16-13-17-33(28-30)36(27-26-31(14-5-2)32-24-22-29(3)23-25-32)38(37,34-18-9-7-10-19-34)35-20-11-8-12-21-35/h7-13,16-25,28,31,36H,4,6,15,26-27H2,1-3H3
InChIKey CJTZMCUERJDKAB-UHFFFAOYSA-N
Molecular Weight 518.681 g/mol
SMILES C(P(=O)(c1ccccc1)c1ccccc1)(c1cc(CCCC)ccc1)CCC(C#CC)c1ccc(cc1)C
SPLASH splash10-0uxr-0096020000-b3e85a3f73482d81f6b3
Source of Spectrum F-68-6256-5
Wiley ID 1573148