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(4S)-3-keto-4-methyl-2-triphenylphosphoranylidene-hexanenitrile
SpectraBase Compound ID 1HldX4NBUla
InChI InChI=1S/C25H24NOP/c1-3-20(2)25(27)24(19-26)28(21-13-7-4-8-14-21,22-15-9-5-10-16-22)23-17-11-6-12-18-23/h4-18,20H,3H2,1-2H3/t20-/m0/s1
InChIKey DTHKKWGXKKTEBJ-FQEVSTJZSA-N
Mol Weight 385.45 g/mol
Molecular Formula C25H24NOP
Exact Mass 385.159551 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CabScLZkAAA
Name (4S)-3-keto-4-methyl-2-triphenylphosphoranylidene-hexanenitrile
Alternate Name(s) (4S)-4-methyl-3-oxo-2-triphenylphosphoranylidenehexanenitrile (4S)-4-methyl-3-oxo-2-(triphenyl-$l^{5}-phosphanylidene)hexanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H24NOP
InChI InChI=1S/C25H24NOP/c1-3-20(2)25(27)24(19-26)28(21-13-7-4-8-14-21,22-15-9-5-10-16-22)23-17-11-6-12-18-23/h4-18,20H,3H2,1-2H3/t20-/m0/s1
InChIKey DTHKKWGXKKTEBJ-FQEVSTJZSA-N
Molecular Weight 385.447 g/mol
SMILES C(=P(c1ccccc1)(c1ccccc1)c1ccccc1)(C(=O)[C@](CC)(C)[H])C#N
SPLASH splash10-004i-0109000000-26aa6b663d9599f644ec
Source of Spectrum KC-0-3412-5
Wiley ID 831777