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3-(3-oxo-3-phenylpropyl)-7-phenyl-4, 6-dihydro-5H-1,2,4-triazepin-5-one
SpectraBase Compound ID KVDi48xBD2l
InChI InChI=1S/C19H17N3O2/c23-17(15-9-5-2-6-10-15)11-12-18-20-19(24)13-16(21-22-18)14-7-3-1-4-8-14/h1-10H,11-13H2,(H,20,22,24)
InChIKey RSVRGMHRVFSMNM-UHFFFAOYSA-N
Mol Weight 319.36 g/mol
Molecular Formula C19H17N3O2
Exact Mass 319.132077 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0Xq4gfi544
Name 3-(3-oxo-3-phenylpropyl)-7-phenyl-4, 6-dihydro-5H-1,2,4-triazepin-5-one
Appearance Yellowish crystals
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Formula C19H17N3O2
InChI InChI=1S/C19H17N3O2/c23-17(15-9-5-2-6-10-15)11-12-18-20-19(24)13-16(21-22-18)14-7-3-1-4-8-14/h1-10H,11-13H2,(H,20,22,24)
InChIKey RSVRGMHRVFSMNM-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP 1000 EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4216
Molecular Weight 319.364 g/mol
SMILES N1C(=NN=C(CC1=O)c1ccccc1)CCC(=O)c1ccccc1
SPLASH splash10-001i-0090000000-01a60dbfa1868a3c2c12
Source of Spectrum Y-58-SM23-16a
Wiley ID 1880907