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1-(4-Methoxyphenyl)-5-(4'-methyl-[1,1'-biphenyl]-2-yl)-1H-tetrazole
SpectraBase Compound ID DRxMXoTRO7e
InChI InChI=1S/C21H18N4O/c1-15-7-9-16(10-8-15)19-5-3-4-6-20(19)21-22-23-24-25(21)17-11-13-18(26-2)14-12-17/h3-14H,1-2H3
InChIKey KAAXPELHVLVNJP-UHFFFAOYSA-N
Mol Weight 342.4 g/mol
Molecular Formula C21H18N4O
Exact Mass 342.148061 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Ks4TSY6im
Name 1-(4-Methoxyphenyl)-5-(4'-methyl-[1,1'-biphenyl]-2-yl)-1H-tetrazole
Appearance Colorless solid
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Exact Mass 342.148061215 u
Formula C21H18N4O
InChI InChI=1S/C21H18N4O/c1-15-7-9-16(10-8-15)19-5-3-4-6-20(19)21-22-23-24-25(21)17-11-13-18(26-2)14-12-17/h3-14H,1-2H3
InChIKey KAAXPELHVLVNJP-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/chem.201500552
Molecular Weight 342.402 g/mol
Reported Formula C21H18N4O
SMILES COC1=CC=C(C=C1)N1N=NN=C1C1=C(C=CC=C1)C1=CC=C(C=C1)C
SPLASH splash10-03dj-0389000000-a46eb300f811681db0cb
Source of Spectrum QE-21-SM30-4b (DOI: 10.1002/chem.201500552)
Wiley ID 1906368