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3-Phenyl-5-(2'-phenylethyl)-pyrazol-4-one - 1,2-dioxide
SpectraBase Compound ID 77X54bcwaYw
InChI InChI=1S/C17H14N2O3/c20-17-15(12-11-13-7-3-1-4-8-13)18(21)19(22)16(17)14-9-5-2-6-10-14/h1-10H,11-12H2
InChIKey QBQWSXWVMSJNBX-UHFFFAOYSA-N
Mol Weight 294.31 g/mol
Molecular Formula C17H14N2O3
Exact Mass 294.100442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C3lso65FY1M
Name 3-Phenyl-5-(2'-phenylethyl)-pyrazol-4-one - 1,2-dioxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14N2O3
InChI InChI=1S/C17H14N2O3/c20-17-15(12-11-13-7-3-1-4-8-13)18(21)19(22)16(17)14-9-5-2-6-10-14/h1-10H,11-12H2
InChIKey QBQWSXWVMSJNBX-UHFFFAOYSA-N
Molecular Weight 294.310 g/mol
SMILES C1(=[N+]([N+](=C(C1=O)c1ccccc1)[O-])[O-])CCc1ccccc1
SPLASH splash10-00kf-9400000000-e60b5c70422881787a53
Source of Spectrum D8-328-768-24
Synonyms 3-Phenyl-5-(2-phenylethyl)-4H-pyrazol-4-one 1,2-dioxide 1,2-Dioxido-3-phenyl-5-(2-phenylethyl)-4-pyrazole-1,2-diiumone 1,2-Dioxido-3-phenyl-5-(2-phenylethyl)pyrazole-1,2-diium-4-one 1,2-bis(oxidanidyl)-3-phenyl-5-(2-phenylethyl)pyrazole-1,2-diium-4-one
Wiley ID 1516022