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1-Benzyl-5-(4'-methoxy-[1,1'-biphenyl]-2-yl)-1H-tetrazole
SpectraBase Compound ID AmbCTooT4XH
InChI InChI=1S/C21H18N4O/c1-26-18-13-11-17(12-14-18)19-9-5-6-10-20(19)21-22-23-24-25(21)15-16-7-3-2-4-8-16/h2-14H,15H2,1H3
InChIKey LMXJOPTYPRPMOE-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 8qgL4TCdRUa
Name 1-Benzyl-5-(4'-methoxy-[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/c1-26-18-13-11-17(12-14-18)19-9-5-6-10-20(19)21-22-23-24-25(21)15-16-7-3-2-4-8-16/h2-14H,15H2,1H3
InChIKey LMXJOPTYPRPMOE-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/chem.201504851
Molecular Weight 342.402 g/mol
Quality 57
Reported Formula C21H18N4O
SMILES C1(=CC=CC=C1)CN1N=NN=C1C1=C(C=CC=C1)C1=CC=C(C=C1)OC
SPLASH splash10-00am-0973000000-422da671b196c15c3735
Source of Spectrum QE-22-SM27-10a (DOI: 10.1002/chem.201504851)
Wiley ID 1903565