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4-[(1E,4E)-deca-1,4-dienyl]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one
SpectraBase Compound ID KMxH3BB0XtD
InChI InChI=1S/C21H28N2O/c1-4-5-6-7-8-9-10-14-17-20-18(2)22(3)23(21(20)24)19-15-12-11-13-16-19/h8-9,11-17H,4-7,10H2,1-3H3/b9-8+,17-14+
InChIKey LFVUQKWFLIITKV-PICNROBXSA-N
Mol Weight 324.47 g/mol
Molecular Formula C21H28N2O
Exact Mass 324.220164 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FvHn35skPOp
Name 4-[(1E,4E)-deca-1,4-dienyl]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28N2O
InChI InChI=1S/C21H28N2O/c1-4-5-6-7-8-9-10-14-17-20-18(2)22(3)23(21(20)24)19-15-12-11-13-16-19/h8-9,11-17H,4-7,10H2,1-3H3/b9-8+,17-14+
InChIKey LFVUQKWFLIITKV-PICNROBXSA-N
Molecular Weight 324.468 g/mol
SMILES C1(N(N(C(=C1\C=C\C\C=C\CCCCC)C)C)c1ccccc1)=O
SPLASH splash10-0udi-0091000000-81b0e5dba7bb9478ac54
Source of Spectrum J-65-4626-7
Synonyms 4-[(1E,4E)-deca-1,4-dienyl]-1,5-dimethyl-2-phenyl-3-pyrazolone 4-[(1E,4E)-deca-1,4-dienyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one
Wiley ID 1532793