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Diethyl 1-benzyl-5-phenyl-4,5-dihydro-1H-1,2,3-triazole-4,4-dicarboxylate
SpectraBase Compound ID ESIsxQeytNd
InChI InChI=1S/C21H23N3O4/c1-3-27-19(25)21(20(26)28-4-2)18(17-13-9-6-10-14-17)24(23-22-21)15-16-11-7-5-8-12-16/h5-14,18H,3-4,15H2,1-2H3
InChIKey DZSPDAZCZZTLDD-UHFFFAOYSA-N
Mol Weight 381.43 g/mol
Molecular Formula C21H23N3O4
Exact Mass 381.168856 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KBPomI2CigX
Name Diethyl 1-benzyl-5-phenyl-4,5-dihydro-1H-1,2,3-triazole-4,4-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23N3O4
InChI InChI=1S/C21H23N3O4/c1-3-27-19(25)21(20(26)28-4-2)18(17-13-9-6-10-14-17)24(23-22-21)15-16-11-7-5-8-12-16/h5-14,18H,3-4,15H2,1-2H3
InChIKey DZSPDAZCZZTLDD-UHFFFAOYSA-N
Molecular Weight 381.432 g/mol
SMILES C1(N=NN(C1c1ccccc1)Cc1ccccc1)(C(=O)OCC)C(=O)OCC
SPLASH splash10-0006-9110000000-3b336e2b203315b2fbfe
Source of Spectrum B-47-1375-0
Synonyms Diethyl 1-benzyl-5-phenyl-1,5-dihydro-4H-1,2,3-triazole-4,4-dicarboxylate
Wiley ID 1360200