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1,4-bis[1'-Benzyl-4'-phenyl-1,2,3-triazol-5'-yl]-buta-1,3-diyne

View entire compound with spectra: 1 MS (GC)

1,4-bis[1'-Benzyl-4'-phenyl-1,2,3-triazol-5'-yl]-buta-1,3-diyne
SpectraBase Compound ID Fj1gZv9NEL2
InChI InChI=1S/C34H24N6/c1-5-15-27(16-6-1)25-39-31(33(35-37-39)29-19-9-3-10-20-29)23-13-14-24-32-34(30-21-11-4-12-22-30)36-38-40(32)26-28-17-7-2-8-18-28/h1-12,15-22H,25-26H2
InChIKey JZRQSCXQLJJRAD-UHFFFAOYSA-N
Mol Weight 516.6 g/mol
Molecular Formula C34H24N6
Exact Mass 516.206245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D5pyM3dih9E
Name 1,4-bis[1'-Benzyl-4'-phenyl-1,2,3-triazol-5'-yl]-buta-1,3-diyne
Alternate Name(s) 1-Benzyl-5-[4-(1-benzyl-4-phenyl-1H-1,2,3-triazol-5-yl)-1,3-butadiynyl]-4-phenyl-1H-1,2,3-triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H24N6
InChI InChI=1S/C34H24N6/c1-5-15-27(16-6-1)25-39-31(33(35-37-39)29-19-9-3-10-20-29)23-13-14-24-32-34(30-21-11-4-12-22-30)36-38-40(32)26-28-17-7-2-8-18-28/h1-12,15-22H,25-26H2
InChIKey JZRQSCXQLJJRAD-UHFFFAOYSA-N
Molecular Weight 516.608 g/mol
SMILES c1(c(nn[n]1Cc1ccccc1)-c1ccccc1)C#CC#Cc1c(nn[n]1Cc1ccccc1)-c1ccccc1
SPLASH splash10-00di-8923000000-4bd3b92876e5f66a9ecf
Source of Spectrum HE-2006-647-11
Wiley ID 1613929