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(E)-1-(1-adamantyl)-3-(1,5-dimethyl-4-pyrazolyl)-2-propen-1-one
SpectraBase Compound ID 7jefj7dPrJg
InChI InChI=1S/C18H24N2O/c1-12-16(11-19-20(12)2)3-4-17(21)18-8-13-5-14(9-18)7-15(6-13)10-18/h3-4,11,13-15H,5-10H2,1-2H3/b4-3+/t13-,14?,15?,18?
InChIKey PRXBAPUGJXTDBN-PXPRUFASSA-N
Mol Weight 284.4 g/mol
Molecular Formula C18H24N2O
Exact Mass 284.188863 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9wfSjA3dhBC
Name (E)-1-(1-adamantyl)-3-(1,5-dimethyl-4-pyrazolyl)-2-propen-1-one
Alternate Name(s) (E)-1-(1-adamantyl)-3-(1,5-dimethylpyrazol-4-yl)prop-2-en-1-one Propenone, 1-(adamantan-1-yl)-3-(1,5-dimethyl-1H-pyrazol-4-yl)-
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Formula C18H24N2O
InChI InChI=1S/C18H24N2O/c1-12-16(11-19-20(12)2)3-4-17(21)18-8-13-5-14(9-18)7-15(6-13)10-18/h3-4,11,13-15H,5-10H2,1-2H3/b4-3+/t13-,14?,15?,18?
InChIKey PRXBAPUGJXTDBN-PXPRUFASSA-N
Molecular Weight 284.403 g/mol
SMILES c1(\C=C\C(=O)C23CC4CC(C3)CC(C2)C4)c([n](nc1)C)C
SPLASH splash10-0002-9600000000-56a9018d6f8e8eceff2b
Wiley ID 1441153