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2-(3,4-diethoxybenzyl)-5-[4-(2-fluorobenzyl)oxyphenyl]tetrazole
SpectraBase Compound ID Kyqvp1sG7fv
InChI InChI=1S/C25H25FN4O3/c1-3-31-23-14-9-18(15-24(23)32-4-2)16-30-28-25(27-29-30)19-10-12-21(13-11-19)33-17-20-7-5-6-8-22(20)26/h5-15H,3-4,16-17H2,1-2H3
InChIKey BJJAAVQNFKDUPD-UHFFFAOYSA-N
Mol Weight 448.5 g/mol
Molecular Formula C25H25FN4O3
Exact Mass 448.191069 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6HCPefCDxuQ
Name 2-(3,4-diethoxybenzyl)-5-[4-(2-fluorobenzyl)oxyphenyl]tetrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H25FN4O3
InChI InChI=1S/C25H25FN4O3/c1-3-31-23-14-9-18(15-24(23)32-4-2)16-30-28-25(27-29-30)19-10-12-21(13-11-19)33-17-20-7-5-6-8-22(20)26/h5-15H,3-4,16-17H2,1-2H3
InChIKey BJJAAVQNFKDUPD-UHFFFAOYSA-N
Molecular Weight 448.498 g/mol
SMILES c1ccc(COc2ccc(-c3nn[n](n3)Cc3cc(OCC)c(cc3)OCC)cc2)c(F)c1
SPLASH splash10-0a4i-2900000000-1c43db98ea8fae7ba70b
Synonyms 2-[(3,4-diethoxyphenyl)methyl]-5-[4-[(2-fluorophenyl)methoxy]phenyl]-1,2,3,4-tetrazole 2-[(3,4-diethoxyphenyl)methyl]-5-[4-[(2-fluorophenyl)methoxy]phenyl]tetrazole
Wiley ID 1445058