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1-(4-Methoxyphenyl)-4,5-dihydrobenzo[c][1,2,3]triazolo[4,5-e]azepin-6(1H)-one
SpectraBase Compound ID J84UscpDUx4
InChI InChI=1S/C17H14N4O2/c1-23-12-8-6-11(7-9-12)21-16-13-4-2-3-5-14(13)17(22)18-10-15(16)19-20-21/h2-9H,10H2,1H3,(H,18,22)
InChIKey RFQGBAVFWYODPR-UHFFFAOYSA-N
Mol Weight 306.32 g/mol
Molecular Formula C17H14N4O2
Exact Mass 306.111676 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1K8WHRyB51K
Name 1-(4-Methoxyphenyl)-4,5-dihydrobenzo[c][1,2,3]triazolo[4,5-e]azepin-6(1H)-one
Appearance Colorless crystals
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Exact Mass 306.111675705 u
Formula C17H14N4O2
InChI InChI=1S/C17H14N4O2/c1-23-12-8-6-11(7-9-12)21-16-13-4-2-3-5-14(13)17(22)18-10-15(16)19-20-21/h2-9H,10H2,1H3,(H,18,22)
InChIKey RFQGBAVFWYODPR-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/chem.201902901
Quality 210
Reported Formula C17H14N4O2
SMILES N1CC2=C(C3=C(C1=O)C=CC=C3)N(N=N2)C1=CC=C(C=C1)OC
SPLASH splash10-0a6r-4911000000-030b710d9a1be177b868
Source of Spectrum QE-25-SM17-9 (DOI: 10.1002/chem.201902901)
Wiley ID 1893902