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.alpha.-Azido-.beta.-[2-butyl-1-(4-carboethoxybenzyl)-imidazol-5-yl]acrylate
SpectraBase Compound ID DtCpxDdu7Fq
InChI InChI=1S/C22H27N5O4/c1-4-7-8-20-24-14-18(13-19(25-26-23)22(29)31-6-3)27(20)15-16-9-11-17(12-10-16)21(28)30-5-2/h9-14H,4-8,15H2,1-3H3/b19-13-
InChIKey GQHQTVQJEYUFCF-UYRXBGFRSA-N
Mol Weight 425.49 g/mol
Molecular Formula C22H27N5O4
Exact Mass 425.206304 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID rzwxy91v5
Name .alpha.-Azido-.beta.-[2-butyl-1-(4-carboethoxybenzyl)-imidazol-5-yl]acrylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H27N5O4
InChI InChI=1S/C22H27N5O4/c1-4-7-8-20-24-14-18(13-19(25-26-23)22(29)31-6-3)27(20)15-16-9-11-17(12-10-16)21(28)30-5-2/h9-14H,4-8,15H2,1-3H3/b19-13-
InChIKey GQHQTVQJEYUFCF-UYRXBGFRSA-N
Molecular Weight 425.489 g/mol
SMILES c1([n](c(nc1)CCCC)Cc1ccc(C(=O)OCC)cc1)\C=C\(C(=O)OCC)N=[N+]=[N-]
SPLASH splash10-052b-0009200000-b190babe7348cac54240
Source of Spectrum Y1-36-814-6
Synonyms .alpha.-Azido-.beta.-[2-butyl-1-(4-carboethoxybenzyl)-5-formylimidazol-5-yl]acrylate Ethyl 4-({5-[(1Z)-2-azido-3-ethoxy-3-oxo-1-propenyl]-2-butyl-1H-imidazol-1-yl}methyl)benzoate
Wiley ID 1527157