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Ethyl 4-Hydroxy-3-nitro-2-phenyl-5-(triphenylphosphoranylidene)cyclopenta-l,3-diene-l-carboxylate
SpectraBase Compound ID I7obrmRPr37
InChI InChI=1S/C32H26NO5P/c1-2-38-32(35)28-27(23-15-7-3-8-16-23)29(33(36)37)30(34)31(28)39(24-17-9-4-10-18-24,25-19-11-5-12-20-25)26-21-13-6-14-22-26/h3-22,34H,2H2,1H3
InChIKey CPERUOHJRQNLMU-UHFFFAOYSA-N
Mol Weight 535.5 g/mol
Molecular Formula C32H26NO5P
Exact Mass 535.15486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Iy6tMOBTXe6
Name Ethyl 4-Hydroxy-3-nitro-2-phenyl-5-(triphenylphosphoranylidene)cyclopenta-l,3-diene-l-carboxylate
Alternate Name(s) Ethyl 4-hydroxy-3-nitro-2-phenyl-5-(triphenyl-lambda5-phosphaneylidene)cyclopenta-1,3-diene-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H26NO5P
InChI InChI=1S/C32H26NO5P/c1-2-38-32(35)28-27(23-15-7-3-8-16-23)29(33(36)37)30(34)31(28)39(24-17-9-4-10-18-24,25-19-11-5-12-20-25)26-21-13-6-14-22-26/h3-22,34H,2H2,1H3
InChIKey CPERUOHJRQNLMU-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.200590012
Molecular Weight 535.536 g/mol
SMILES OC1=C([N+](=O)[O-])C(c2ccccc2)=C(C(=O)OCC)C1=P(c1ccccc1)(c1ccccc1)c1ccccc1
SPLASH splash10-01si-5930000000-6ba0d14d78ec5047039b
Source of Spectrum H-88-307-1b
Wiley ID 1785615