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4-Allyl-1,5-dimethyl-2-phenyl-1,2-dihydropyrazol-3-one
SpectraBase Compound ID 13hxCaRQU4i
InChI InChI=1S/C14H16N2O/c1-4-8-13-11(2)15(3)16(14(13)17)12-9-6-5-7-10-12/h4-7,9-10H,1,8H2,2-3H3
InChIKey IIWQOJBCXMJFFB-UHFFFAOYSA-N
Mol Weight 228.29 g/mol
Molecular Formula C14H16N2O
Exact Mass 228.126263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6NnVxdtwsBp
Name 4-Allyl-1,5-dimethyl-2-phenyl-1,2-dihydropyrazol-3-one
Comments Less than 3 mono-isotopic peaks
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Formula C14H16N2O
InChI InChI=1S/C14H16N2O/c1-4-8-13-11(2)15(3)16(14(13)17)12-9-6-5-7-10-12/h4-7,9-10H,1,8H2,2-3H3
InChIKey IIWQOJBCXMJFFB-UHFFFAOYSA-N
Molecular Weight 228.295 g/mol
SMILES C1(N(N(C(=C1CC=C)C)C)c1ccccc1)=O
SPLASH splash10-004i-0090000000-799944a72fb8a91da672
Source of Spectrum J-65-4626-6
Synonyms 4-allyl-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one 1,5-dimethyl-2-phenyl-4-prop-2-enyl-3-pyrazolone 1,5-dimethyl-2-phenyl-4-prop-2-enylpyrazol-3-one 4-allyl-1,5-dimethyl-2-phenyl-pyrazol-3-one 1,5-dimethyl-2-phenyl-4-prop-2-enyl-pyrazol-3-one
Wiley ID 1532801