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9-(4'-Methoxyphenyl)-6,6-dimethyl-6,7-dihydro-5H-[1,2,4]triazolo[5,1-b]-quinazolin-8-one
SpectraBase Compound ID HDmkimIzPxU
InChI InChI=1S/C18H18N4O2/c1-18(2)8-13-15(14(23)9-18)16(22-17(21-13)19-10-20-22)11-4-6-12(24-3)7-5-11/h4-7,10H,8-9H2,1-3H3
InChIKey PQCPBFAXRMFTLO-UHFFFAOYSA-N
Mol Weight 322.37 g/mol
Molecular Formula C18H18N4O2
Exact Mass 322.142976 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DZnWkevhJBw
Name 9-(4'-Methoxyphenyl)-6,6-dimethyl-6,7-dihydro-5H-[1,2,4]triazolo[5,1-b]-quinazolin-8-one
Appearance Yellow crystals
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Exact Mass 322.142975834 u
Formula C18H18N4O2
InChI InChI=1S/C18H18N4O2/c1-18(2)8-13-15(14(23)9-18)16(22-17(21-13)19-10-20-22)11-4-6-12(24-3)7-5-11/h4-7,10H,8-9H2,1-3H3
InChIKey PQCPBFAXRMFTLO-UHFFFAOYSA-N
Instrument Name Finnigan MAT 8430
Ionization Type EI
Literature Reference DOI 10.1186/1860-5397-3-11
Molecular Weight 322.368 g/mol
Quality 230
SMILES C=1(N2C(N=C3C1C(CC(C3)(C)C)=O)=NC=N2)C1=CC=C(C=C1)OC
SPLASH splash10-05fr-2629000000-a4d96a274fd806174395
Source of Spectrum BJO-3-SM4-6a (DOI: 10.1186/1860-5397-3-11)
Wiley ID 1908948