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Ethyl 4-hydroxy-3-nitro-2-(p-chlorophenyl)-5-(triphenylphosphoranylidene)-cyclopenta-1,3-diene-1-carboxylate
SpectraBase Compound ID 804J23TqGas
InChI InChI=1S/C32H25ClNO5P/c1-2-39-32(36)28-27(22-18-20-23(33)21-19-22)29(34(37)38)30(35)31(28)40(24-12-6-3-7-13-24,25-14-8-4-9-15-25)26-16-10-5-11-17-26/h3-21,35H,2H2,1H3
InChIKey CITSAHNCBDPUKL-UHFFFAOYSA-N
Mol Weight 570.0 g/mol
Molecular Formula C32H25ClNO5P
Exact Mass 569.115888 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ji8AoBlGNq9
Name Ethyl 4-hydroxy-3-nitro-2-(p-chlorophenyl)-5-(triphenylphosphoranylidene)-cyclopenta-1,3-diene-1-carboxylate
Alternate Name(s) Ethyl 2-(4-chlorophenyl)-4-hydroxy-3-nitro-5-(triphenylphosphoranylidene)-1,3-cyclopentadiene-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H25ClNO5P
InChI InChI=1S/C32H25ClNO5P/c1-2-39-32(36)28-27(22-18-20-23(33)21-19-22)29(34(37)38)30(35)31(28)40(24-12-6-3-7-13-24,25-14-8-4-9-15-25)26-16-10-5-11-17-26/h3-21,35H,2H2,1H3
InChIKey CITSAHNCBDPUKL-UHFFFAOYSA-N
Molecular Weight 569.981 g/mol
SMILES OC1=C(C(=C(C(=O)OCC)C1=P(c1ccccc1)(c1ccccc1)c1ccccc1)c1ccc(cc1)Cl)N(=O)=O
SPLASH splash10-005c-7980000000-5180e3470b7b0189fbb1
Source of Spectrum C-88-307-1
Wiley ID 1590166