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1,5-dimethyl-2-phenyl-4-(pyridin-2-yl)-1,2-dihydro-3H-pyrazol-3-one
SpectraBase Compound ID FPo3PsNfjS0
InChI InChI=1S/C16H15N3O/c1-12-15(14-10-6-7-11-17-14)16(20)19(18(12)2)13-8-4-3-5-9-13/h3-11H,1-2H3
InChIKey XRHDSHWMFNODTI-UHFFFAOYSA-N
Mol Weight 265.32 g/mol
Molecular Formula C16H15N3O
Exact Mass 265.121512 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9QB9ejFbIPv
Name 1,5-dimethyl-2-phenyl-4-(pyridin-2-yl)-1,2-dihydro-3H-pyrazol-3-one
Appearance Pale yellow solid
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Formula C16H15N3O
InChI InChI=1S/C16H15N3O/c1-12-15(14-10-6-7-11-17-14)16(20)19(18(12)2)13-8-4-3-5-9-13/h3-11H,1-2H3
InChIKey XRHDSHWMFNODTI-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/acs.orglett.0c03939
Molecular Weight 265.316 g/mol
Reported Formula C16H15N3O
SMILES CC1=C(C(N(N1C)c1ccccc1)=O)c1ncccc1
SPLASH splash10-014i-0090000000-136854a6612ff2c81753
Source of Spectrum A1-23-SM18-3x
Wiley ID 1854993