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Diethyl 2-(5-hydroxy-3-methyl-1H-pyrazol-1-yl)-3-(triphenylphosphoranylidene)succinate
SpectraBase Compound ID FSWj6KAnIZf
InChI InChI=1S/C30H31N2O5P/c1-4-36-29(34)27(32-26(33)21-22(3)31-32)28(30(35)37-5-2)38(23-15-9-6-10-16-23,24-17-11-7-12-18-24)25-19-13-8-14-20-25/h6-21,27,33H,4-5H2,1-3H3
InChIKey LHUMPDUXUFUDEC-UHFFFAOYSA-N
Mol Weight 530.56 g/mol
Molecular Formula C30H31N2O5P
Exact Mass 530.197059 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 204yp9S7lLS
Name Diethyl 2-(5-hydroxy-3-methyl-1H-pyrazol-1-yl)-3-(triphenylphosphoranylidene)succinate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H31N2O5P
InChI InChI=1S/C30H31N2O5P/c1-4-36-29(34)27(32-26(33)21-22(3)31-32)28(30(35)37-5-2)38(23-15-9-6-10-16-23,24-17-11-7-12-18-24)25-19-13-8-14-20-25/h6-21,27,33H,4-5H2,1-3H3
InChIKey LHUMPDUXUFUDEC-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cjoc.201200199
Molecular Weight 530.561 g/mol
SMILES Oc1[n](C(C(=P(c2ccccc2)(c2ccccc2)c2ccccc2)C(=O)OCC)C(OCC)=O)nc(c1)C
SPLASH splash10-0io1-3951610000-559f7e905a37638f2098
Source of Spectrum CJC-30-1898-15g
Wiley ID 1772782