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5-Amino-1-[2-(naphthalen-3-yloxy)acetyl]-1H-pyrazole-4-carbonitrile
SpectraBase Compound ID 6zzgJCSmNNV
InChI InChI=1S/C16H12N4O2/c17-8-13-9-19-20(16(13)18)15(21)10-22-14-6-5-11-3-1-2-4-12(11)7-14/h1-7,9H,10,18H2
InChIKey WSOPIPCONBWROK-UHFFFAOYSA-N
Mol Weight 292.3 g/mol
Molecular Formula C16H12N4O2
Exact Mass 292.096026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G6dufTM6afy
Name 5-Amino-1-[2-(naphthalen-3-yloxy)acetyl]-1H-pyrazole-4-carbonitrile
Alternate Name(s) 5-amino-1-[2-(2-naphthalenyloxy)-1-oxoethyl]-4-pyrazolecarbonitrile 5-amino-1-(2-naphthalen-2-yloxyacetyl)pyrazole-4-carbonitrile 5-amino-1-[2-(2-naphthyloxy)acetyl]pyrazole-4-carbonitrile 5-azanyl-1-(2-naphthalen-2-yloxyethanoyl)pyrazole-4-carbonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C16H12N4O2
InChI InChI=1S/C16H12N4O2/c17-8-13-9-19-20(16(13)18)15(21)10-22-14-6-5-11-3-1-2-4-12(11)7-14/h1-7,9H,10,18H2
InChIKey WSOPIPCONBWROK-UHFFFAOYSA-N
Molecular Weight 292.298 g/mol
SMILES Nc1[n](ncc1C#N)C(COc1cc2ccccc2cc1)=O
SPLASH splash10-0006-0090000000-d551bce77321e791094f
Source of Spectrum E1-57-1350-7
Wiley ID 1661772