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5-methyl-2,5-diphenyl-4-[1-(sec-butylamino)ethylidene]pyrazolidin-3-one
SpectraBase Compound ID 1tVPyhsWD17
InChI InChI=1S/C22H27N3O/c1-5-16(2)23-17(3)20-21(26)25(19-14-10-7-11-15-19)24-22(20,4)18-12-8-6-9-13-18/h6-16,23-24H,5H2,1-4H3
InChIKey ZGVMFBYHOPFEGF-UHFFFAOYSA-N
Mol Weight 349.48 g/mol
Molecular Formula C22H27N3O
Exact Mass 349.215413 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JfiXJxO0Hc3
Name 5-methyl-2,5-diphenyl-4-[1-(sec-butylamino)ethylidene]pyrazolidin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 349.215412500 u
Formula C22H27N3O
InChI InChI=1S/C22H27N3O/c1-5-16(2)23-17(3)20-21(26)25(19-14-10-7-11-15-19)24-22(20,4)18-12-8-6-9-13-18/h6-16,23-24H,5H2,1-4H3
InChIKey ZGVMFBYHOPFEGF-UHFFFAOYSA-N
Instrument Name VG ZabSpec
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0004.510
Quality 276
SMILES N1C(C(=C(NC(CC)C)C)C(N1C1=CC=CC=C1)=O)(C)C1=CC=CC=C1
SPLASH splash10-000x-9014000000-e1a2f664e510e56a1226
Source of Spectrum ARK-2003-108-9c (DOI: 10.3998/ark.5550190.0004.510)
Thin-Layer Chromatography 0.58 (benzene/acetonitrile, 5:1)
Wiley ID 1899950