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5-Benzyl-1-(4'-[2.2]paracyclophanyl)-1H-tetrazole
SpectraBase Compound ID DgzCdCBmI4U
InChI InChI=1S/C24H22N4/c1-2-4-20(5-3-1)17-24-25-26-27-28(24)23-16-21-11-10-18-6-8-19(9-7-18)12-14-22(23)15-13-21/h1-9,13,15-16H,10-12,14,17H2
InChIKey WMGCXDUUIDNAAO-UHFFFAOYSA-N
Mol Weight 366.47 g/mol
Molecular Formula C24H22N4
Exact Mass 366.184447 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID j3r07GrwUU
Name 5-Benzyl-1-(4'-[2.2]paracyclophanyl)-1H-tetrazole
Alternate Name(s) 5-Benzyl-1-tricyclo[8.2.2.2(4,7)]hexadeca-1(12),4,6,10,13,15-hexaen-5-yl-1H-tetraazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H22N4
InChI InChI=1S/C24H22N4/c1-2-4-20(5-3-1)17-24-25-26-27-28(24)23-16-21-11-10-18-6-8-19(9-7-18)12-14-22(23)15-13-21/h1-9,13,15-16H,10-12,14,17H2
InChIKey WMGCXDUUIDNAAO-UHFFFAOYSA-N
Molecular Weight 366.468 g/mol
SMILES c1([n](nnn1)-c1c2ccc(c1)CCc1ccc(CC2)cc1)Cc1ccccc1
SPLASH splash10-0udl-6976000000-57530743bd42fed7328e
Source of Spectrum Y1-46-2682-6
Wiley ID 1622449