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4H-1-Benzopyran-4-one, 2,3-dihydro-3-methyl-2-phenyl-3-[(triphenylphosphoranylidene)amino]-, cis-
SpectraBase Compound ID 2onPMkuNVna
InChI InChI=1S/C34H28NO2P/c1-34(32(36)30-24-14-15-25-31(30)37-33(34)26-16-6-2-7-17-26)35-38(27-18-8-3-9-19-27,28-20-10-4-11-21-28)29-22-12-5-13-23-29/h2-25,33H,1H3/t33-,34-/m0/s1
InChIKey MXTJSLFWTZUAPB-HEVIKAOCSA-N
Mol Weight 513.6 g/mol
Molecular Formula C34H28NO2P
Exact Mass 513.185766 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IDLxH3CKLrv
Name 4H-1-Benzopyran-4-one, 2,3-dihydro-3-methyl-2-phenyl-3-[(triphenylphosphoranylidene)amino]-, cis-
CAS Registry Number 116703-71-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H28NO2P
InChI InChI=1S/C34H28NO2P/c1-34(32(36)30-24-14-15-25-31(30)37-33(34)26-16-6-2-7-17-26)35-38(27-18-8-3-9-19-27,28-20-10-4-11-21-28)29-22-12-5-13-23-29/h2-25,33H,1H3/t33-,34-/m0/s1
InChIKey MXTJSLFWTZUAPB-HEVIKAOCSA-N
Molecular Weight 513.577 g/mol
SMILES [C@@]1(N=P(c2ccccc2)(c2ccccc2)c2ccccc2)(C(c2ccccc2O[C@]1(c1ccccc1)[H])=O)C
SPLASH splash10-03du-0953020000-be18751874bdb8712c82
Source of Spectrum Y-25-346-17
Synonyms (2S,3R)-3-methyl-2-phenyl-3-[(triphenylphosphoranylidene)amino]-2,3-dihydro-4H-chromen-4-one 2,3-Dihydro-t-3-methyl-r-2-phenyl-c-3-(triphenylphosphoranediylamino)-4H-1-benzopyran-4-one
Wiley ID 1400999