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2-(4-methylphenyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]azepin-4-one
SpectraBase Compound ID IRlb7CJv0nT
InChI InChI=1S/C15H16N2O/c1-11-5-7-12(8-6-11)13-10-14-15(18)4-2-3-9-17(14)16-13/h5-8,10H,2-4,9H2,1H3
InChIKey SIQPGOGWSMFHRT-UHFFFAOYSA-N
Mol Weight 240.31 g/mol
Molecular Formula C15H16N2O
Exact Mass 240.126263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HgF7Ug5vdni
Name 2-(4-methylphenyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]azepin-4-one
Comments Less than 3 mono-isotopic peaks
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Formula C15H16N2O
InChI InChI=1S/C15H16N2O/c1-11-5-7-12(8-6-11)13-10-14-15(18)4-2-3-9-17(14)16-13/h5-8,10H,2-4,9H2,1H3
InChIKey SIQPGOGWSMFHRT-UHFFFAOYSA-N
Molecular Weight 240.306 g/mol
SMILES c12[n](nc(c2)-c2ccc(cc2)C)CCCCC1=O
SPLASH splash10-01ox-0090000000-3cda76c401320323d85c
Source of Spectrum D1-1997-1014-4
Synonyms 2-(p-tolyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]azepin-4-one 2-(p-tolyl)-5,6,7,8-tetrahydropyrazol[1,5-a]azepin-4-one
Wiley ID 835018