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1-(2-Methoxybenzyl)-5-{4'-[(4-methoxybenzyloxy)methyl]-[1,1'-biphenyl]-2-yl}-1Htetrazole
SpectraBase Compound ID 3ogVrSdyXwv
InChI InChI=1S/C30H28N4O3/c1-35-26-17-13-23(14-18-26)21-37-20-22-11-15-24(16-12-22)27-8-4-5-9-28(27)30-31-32-33-34(30)19-25-7-3-6-10-29(25)36-2/h3-18H,19-21H2,1-2H3
InChIKey GSSXTEZKUVLCOP-UHFFFAOYSA-N
Mol Weight 492.58 g/mol
Molecular Formula C30H28N4O3
Exact Mass 492.216141 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lj3KgpS4ZdM
Name 1-(2-Methoxybenzyl)-5-{4'-[(4-methoxybenzyloxy)methyl]-[1,1'-biphenyl]-2-yl}-1Htetrazole
Appearance Oil
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Exact Mass 492.216140775 u
Formula C30H28N4O3
InChI InChI=1S/C30H28N4O3/c1-35-26-17-13-23(14-18-26)21-37-20-22-11-15-24(16-12-22)27-8-4-5-9-28(27)30-31-32-33-34(30)19-25-7-3-6-10-29(25)36-2/h3-18H,19-21H2,1-2H3
InChIKey GSSXTEZKUVLCOP-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/chem.201500552
Molecular Weight 492.579 g/mol
Quality 47
Reported Formula C30H28N4O3
SMILES COC1=C(C=CC=C1)CN1N=NN=C1C1=C(C=CC=C1)C1=CC=C(C=C1)COCC1=CC=C(C=C1)OC
SPLASH splash10-05fr-0932000000-54d66a378d8f0d533ee0
Source of Spectrum QE-21-SM32-4e (DOI: 10.1002/chem.201500552)
Wiley ID 1906371