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4-Benzoyl-2-heptyl-5-methyl-2,4-dihydro-3H-pyrazol-3-one
SpectraBase Compound ID H2Baz4HU9k3
InChI InChI=1S/C18H24N2O2/c1-3-4-5-6-10-13-20-18(22)16(14(2)19-20)17(21)15-11-8-7-9-12-15/h7-9,11-12,16H,3-6,10,13H2,1-2H3
InChIKey YAPYNCGECVXNED-UHFFFAOYSA-N
Mol Weight 300.4 g/mol
Molecular Formula C18H24N2O2
Exact Mass 300.183778 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JPdU0f4jvra
Name 4-Benzoyl-2-heptyl-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24N2O2
InChI InChI=1S/C18H24N2O2/c1-3-4-5-6-10-13-20-18(22)16(14(2)19-20)17(21)15-11-8-7-9-12-15/h7-9,11-12,16H,3-6,10,13H2,1-2H3
InChIKey YAPYNCGECVXNED-UHFFFAOYSA-N
Molecular Weight 300.402 g/mol
SMILES C1(C(N(CCCCCCC)N=C1C)=O)C(=O)c1ccccc1
SPLASH splash10-0uxr-0193000000-f996b92872e7d5c1f8bd
Synonyms 2-Heptyl-5-methyl-4-(phenylcarbonyl)-4H-pyrazol-3-one 4-Benzoyl-2-heptyl-5-methyl-2,4-dihydro-pyrazol-3-one 4-Benzoyl-2-heptyl-5-methyl-2-pyrazolin-3-one 4-Benzoyl-2-heptyl-5-methyl-4H-pyrazol-3-one
Wiley ID 1465709